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Cơ sở của phổ phân tử - Ứng dụng trong phân tích vật chất.
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C s ph phn t v
ng dng trong phn tch vt cht
TRNG I HC M - A CHT KHOA DU KH
B MN LC HA DU
TRNH BY C S PH PHN T V NG DNG TRONG PHN TCH VT CHT
1.KIM THANH H 2.NGUYN NGC HIU 3.NG NGC HIN
Nhm sinh vin thc hin
Gio vin hng dn : TS.TNG TH THANH HNG
1# bn cht s hnh thnh thnh ph phn t
2# Mt s ng dng trong phn tch vt cht
ngha
Ni dung
S HNH THNH PH PHN T
ng dng ph phn t
V d phn tch ph phn t
S hnh thnh ph phn t
1.S bc x in t v trng thi nng lng ca phn t
2.Cc phng php ph hp th phn t
3.nh lut Lambert beer
4.Biu din ph hp th phn t
S hnh thnh ph phn t
1.S bc x in t v trng thi nng lng ca phn t
2.Cc phng php ph hp th phn t
3.nh lut Lambert beer
4.Biu din ph hp th phn t
Phn t tn ti nhiu chuyn ng
Chuyn ng ca cc phn t quay ht nhn Chuyn ng tun hon ca cc ht nhn vi
nhau. Chuyn ng thay i hng ton phn.
S thay i trng thi lng t ca phn t s dn n s bin thin nng lng
Phn t ch tn ti trong trng thi kch thch trong khong thi gian rt ngn (10-6 -10-9 ) v quay tr li
trng thi ban u.
Q u t r n h p h t x Qu trnh mt phn t chuyn trng thi lng t cao hn sang thp hn v thot
ra mt photon
Qu trnh hp th Qu trnh mt phn t chuyn t trng thi lng t thp hn sang cao hn v
hp th mt photon
Q u t r n h p h t x Qu trnh mt phn t chuyn trng thi lng t cao hn sang thp hn v thot
ra mt photon
Qu trnh hp th Qu trnh mt phn t chuyn t trng thi lng t thp hn sang cao hn v
hp th mt photon
= Ecao - Ethp = h.
E = 0: nng lng phn t khng thay i khi tng tc vi bc x in t.
E > 0: phn t hp th nng lng. E < 0: phn t bc x nng lng
Nng lng c phn t lu gi di ba dng quay, dao ng v in t
= quay + dao ng +in t
hin tng bc xa in t ca phn t gy nn cc bc chuyn nng lng quay, dao
ng v in t ca phn t l ngun gc
ca cc loi ph hp th
S hnh thnh ph phn t
1.S bc x in t v trng thi nng lng ca phn t
2.Cc phng php ph hp th phn t
3.nh lut Lambert beer
4.Biu din ph hp th phn t
= h.
= quay + dao ng +in t
Mi bc x in t c mt tn s ring gi l tn s quay q, tn s dao ng d v tn
s kch thch in t e.
Hin tng bc x in t ca phn t hnh thnh m ph c
tn s xc nh
Ph quay
Ph dao ng quay
Ph in t - dao ng quay.
Ph quay Hp th trong vng vi sng hay vng hng ngoi xa lm thay i trng thi quay Ph quay thun ty gm cc vch rt xt nhau v cch u
nhau vi tn s : q =
Ph dao ng - quay Hp th bc x vng hng ngoi gn, trng thi dao ng b kch thch (trng thi electron vn khng i) Ph quay-dao ng-in t Hp th bc x c nng lng ln hn nh cc bc x kh kin hay bc x t ngoi
Ph quay Hp th trong vng vi sng hay vng hng ngoi xa lm thay i trng thi quay Ph quay thun ty gm cc vch rt xt nhau v cch u
nhau vi tn s : q =
Ph quay Hp th trong vng vi sng hay vng hng ngoi xa lm thay i trng thi quay Ph quay thun ty gm cc vch rt xt nhau v cch u
nhau vi tn s : q =
Ph dao ng - quay Hp th bc x vng hng ngoi gn, trng thi dao ng
b kch thch . d =
(trng thi electron vn khng i)
V d > > q nn cng vi s bin thin nng lng dao ng lun c bin thin nng lng quay. Ph ta thu c cc m vch vi tn s
= q + q Ph dao ng - quay ( ph dao ng hay ph hng ngoi ).
Ph quay Hp th trong vng vi sng hay vng hng ngoi xa lm thay i trng thi quay Ph quay thun ty gm cc vch rt xt nhau v cch u
nhau vi tn s : q =
Ph dao ng - quay Hp th bc x vng hng ngoi gn, trng thi dao ng b kch thch (trng thi electron vn khng i) Ph quay-dao ng-in t Hp th bc x c nng lng ln hn nh cc bc x kh kin
hay bc x t ngoi . e =
S thay i trng thi electron lun c s thay i trng thi dao ng v trng thi quay nn ta s thu c m vch vi tn s
= q + q + e Ph hp th electron hay ph electron (ph t ngoi kh kin ).
Ph quay Hp th trong vng vi sng hay vng hng ngoi xa lm thay i trng thi quay Ph quay thun ty gm cc vch rt xt nhau v cch u
nhau vi tn s : q =
Ph dao ng - quay Hp th bc x vng hng ngoi gn, trng thi dao ng b kch thch (trng thi electron vn khng i) Ph quay-dao ng-in t Hp th bc x c nng lng ln hn nh cc bc x kh kin hay bc x t ngoi
S hnh thnh ph phn t
1.S bc x in t v trng thi nng lng ca phn t
2.Cc phng php ph hp th phn t
3.nh lut Lambert beer
4.Biu din ph hp th phn t
3# nh lut Lambert beer
C s s dng ph hng ngoi v ph t ngoi -kh kin
Vi hai tia sng c cng nng lng nhng c cng sng khc nhau :
truyn qua : T= I/Io .100%. hp th :A= (Io I )/ Io .100%.
aaaaaa
T v A Ph thuc vo bn cht ca cht ha tan . chiu dy d ca lp mng v nng C ca dung dch . Biu theo cng thc:
gi l h s hp th, C c tnh bng mol/l, d tnh bng cm v D l mt quang
Note :Phng trnh trn ch ng vi tia n sc
Trn trc tung: A, D, , lg , T Trn trc honh: tn s bc x , s
sng , bc sng bc x kch thch .
Xy dng th t nh lut Lambert - Beer
S ph thuc ca D vo bc sng: D . = f( . )
Vi cng mt cht nhng vi cc tia sng khc nhau
s cho cc ng th khc nhau. Dng phng trnh ny phn tch nh lng
S ph thuc ca h s hp th vo chiu di ca bc sng kch thch
Hai ng biu din ny dng phn tch cu to ca cc hp cht
S hnh thnh ph phn t
1.S bc x in t v trng thi nng lng ca phn t
2.Cc phng php ph hp th phn t
3.nh lut Lambert beer
4.Biu din ph hp th phn t
Ph hng ngoi
t
ruy
n q
ua
(%)
Bc sng
Ph thng c ghi di dng th hin s ph thuc ca % truyn qua vo s sng ( hoc bc sng ) ca bc x
Ph t ngoi kh kin
H
s
hp
th
m
ol
Bc sng
Th hin s ph thuc ca mt quang D (A) vo bc sng ( hoc s sng )
so snh gia cc cht , gia cc cu to khc nhau th ph d th hin s ph thuc ca h s hp th mol (hoc lg ) vo bc sng.
Ni dung
S HNH THNH PH PHN T
ng dng ph phn t
V d phn tch ph phn t
S dng ph hng ngoi v Ph t ngoi kh kin trong phn tch vt cht
ng dng ca ph phn t
# Phng php ph t ngoi - kh kin # C ngha quan trng trong phn tch nh tnh,
phn tch cu trc phn t v phn tch nh lng
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
u im ca ph t ngoi kh kin
Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim , bnh vin
Cht hp th trc tip Nhng nhm chc mang mu hu c.
Mt s cht v nh nhng ion kim loi chuyn tip mang mu trong dung dch nh Cu2+,Ni2+hoc cc ion MnO4-,
Cr2O72-
Cht khng hp th trc tip Cht hay ion v d ion kim loi khng hp th trc tip
hoc hp thu vi cng yu. Thm cc thuc th v c, thit lp mi trng thch hp chuyn ton b cht hoc ion phn tch v dng
phc c th hp th trc tip.
Cht hp th trc tip Nhng nhm chc mang mu hu c.
Mt s cht v nh nhng ion kim loi chuyn tip mang mu trong dung dch nh Cu2+,Ni2+hoc cc ion MnO4-,
Cr2O72-
Cht khng hp th trc tip Cht hay ion v d ion kim loi khng hp th trc tip
hoc hp thu vi cng yu. Thm cc thuc th v c, thit lp mi trng thch hp chuyn ton b cht hoc ion phn tch v dng
phc c th hp th trc tip
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
u im ca ph t ngoi kh kin Kh nng p dng rng Phn ln cc cht hu c, v c, ha sinh hp th trc tip v hp th khng trc tip. Khong 90% cc phn tch trong phng th nghim bnh vin.
nhy cao Gii hn d trong khong 10-4 n 10-5M ,c th c m rng n 10-6 thm ch 10-7 M vi nhng th tc b sung.
chn lc t trung bnh n cao
C th hp th mt cht m khng phi tch khi hn hp.
chnh xc cao Sai s nm trong khong 1-5%.
Mt s ng dng khc
Xc nh hng s cn bng, hng s phn
li v nghin cu ng. L c s ca phng php o quang ,
ng dng trong nhiu ngnh: dc , luyn kim , a cht, nng nghip.
L phng php h tr quan trng cho ph hng ngoi v cng hng t ht nhn ng nht cc cht.
Ph hng ngoi
ng nht cc cht S liu cho kt qu ng nht, qu trnh ng nht l so snh ph ca cht nghin cu vi ph chun.
Xc nh cu trc phn t Cc nhm chc trong phn t v c tnh ca lin kt cng nh cu trc v v tr cc nhm th trong hp cht.
Phn tch nh lng Km chnh xc hn so vi cc phng php khc (nh ph t ngoi kh kin UV-Vis). Phn tch dung dch kt qu chnh xc hn so vi mu dng rn.
Ph hng ngoi
ng nht cc cht S liu cho kt qu ng nht, qu trnh ng nht l so snh ph ca cht nghin cu vi ph chun.
Ph chun
L cc tn s ,nhng tn s ny c xc nh bi cc nh khoa hc v c
a vo bng tra cu.
Ph hng ngoi
ng nht cc cht S liu cho kt qu ng nht, qu trnh ng nht l so snh ph ca cht nghin cu vi ph chun.
Xc nh cu trc phn t Cc nhm chc trong phn t v c tnh ca lin kt cng nh cu trc v v tr cc nhm th trong hp cht.
Phn tch nh lng Km chnh xc hn so vi cc phng php khc (nh ph t ngoi kh kin UV-Vis). Phn tch dung dch kt qu chnh xc hn so vi mu dng rn.
Ph hng ngoi
ng nht cc cht S liu cho kt qu ng nht, qu trnh ng nht l so snh ph ca cht nghin cu vi ph chun.
Xc nh cu trc phn t Cc nhm chc trong phn t v c tnh ca lin kt cng nh cu trc v v tr cc nhm th trong hp cht.
Phn tch nh lng Km chnh xc hn so vi cc phng php khc (nh ph t ngoi kh kin UV-Vis). Phn tch dung dch kt qu chnh xc hn so vi mu dng rn.
Ph hng ngoi
ng nht cc cht S liu cho kt qu ng nht, qu trnh ng nht l so snh ph ca cht nghin cu vi ph chun.
Xc nh cu trc phn t Cc nhm chc trong phn t v c tnh ca lin kt cng nh cu trc v v tr cc nhm th trong hp cht.
Phn tch nh lng Km chnh xc hn so vi cc phng php khc (nh ph t ngoi kh kin UV-Vis). Phn tch dung dch kt qu chnh xc hn so vi mu dng rn.
Ni dung
S HNH THNH PH PHN T
ng dng ph phn t
V d phn tch ph phn t
V d v v phn tch ph
Xt mt v d vi ph hng ngoi
1
Ghi cc vng ph (chn peak), (nh peak). Ch cc peak c trng: c im (nh kp, mnh v rng, yu v hep, nhn v hp, chn rng ... )
Cc bc tin hnh
2 T cng thc phn t, d on c th cha dao ng ca nhng nhm cha no?
Cc peak ca ph c th ng vi dao ng ca nhng nhm chc no? 3
i chiu 4
Ph hng ngoi hexanoic acid
HT RI
Cm n c v cc bn lng nghe v theo di.