Environmental Engineering Reference
In-Depth Information
Table 3.9 Corrected thermochemical data of some groups
No.
Group and bond
Structure
Correct value
f (kJ/mol)
1
Sulfur-containing groups in
aromatic hydrocarbon
Ar - SO 3 H
98
2
Fused nucleus of aromatics
84
3
Nitro atom group in aliphatic and
aromatic compounds
R
NO 2
54.4
-
Carboxyl atom group in aromatic
acids
Ar - COOH
54.4
4
Nitro atom group in gem-dinitro
chemicals
R - CH(NO 2 ) 2
41.8
5
Aromatic radical bonding
Ar:Ar
27.2
Aromatic radical and olefin radical
Ar:C=C
27.2
Aromatic radical and alkyne
radical
Ar:C C
27.2
Nitro atom group in
trinitromethane
R
-
C(NO 2 ) 3
27.2
Aromatic radical and nitrile group
Ar:CN
27.2
Urea atom groups
C=ON=
27.2
6
Aromatic and aliphatic radicals
Ar:ALK
14.6
Aromatic radical and nitrogen
(ammonia-type)
Ar
N=
14.6
-
Quaternary carbon atom
(R) 4 C
14.6
-
Amides
R - CONH 2
14.6
7
Carboxyl atom groups in acid
ALK
COOH
0
-
Nitrates
R
ONO 2
0
-
Nitro atom group in
tetranitromethane
C(NO 2 ) 4
0
8
Tert-alcohol
(R) 3 C - OH
+14.6
Phenols
Ar
OH
+14.6
-
Nitro amines
R
NHNO 2
+14.6
-
9
Secondary alcohol
R 2 CH - OH
+27.2
Ethylene bond in the ring
+27.2
H 2 CCH 2
CH
CH
H 2 C
H 2 C
Aliphatic and aromatic ketones
R 2 C=O
+27.2
Amide with substituted group
+27.2
O
HC
NHN(R )
2
Aromatic radical and chlorine
Ar:Cl
+27.2
Oxyacids
+27.2
R 1
COOH
C
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