Formula |
C13H12ClNO2 |
IUPAC Name |
4-[2-(4-chlorophenyl)ethyl]-1h-pyrrole-2-carboxylic acid |
Molecular Mass |
249.693 g·mol−1 |
Heat of Formation |
-254.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.34 ± 1.08 D |
Volume |
289.69 Å 3 |
Surface Area |
273.49 Å 2 |
HOMO Energy |
-9.45 ± 0.55 eV |
LUMO Energy |
-0.66 ± eV |
Point Group Symmetry |
C1
|
Synonyms
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-
- (
- )
- -
- 1
- 2
- 4
- [
- ]
- a
- b
- c
- d
- e
- h
- i
- l
- n
- o
- p
- r
- t
- x
- y
|
InChIKey |
JXYKONJPFAHRTG-UHFFFAOYSA-N |
QR Code |
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Links |
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|
DOI |
|
Downloads |
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|
Elements |
H
C
N
O
Cl
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