Formula |
C25H16ClN3O2 |
IUPAC Name |
3-[(e)-3-(benzimidazol-1-ium-2-yl)prop-2-enoyl]-6-chloro-4-phenyl-quinolin-2-one |
Molecular Mass |
425.866 g·mol−1 |
Heat of Formation |
177.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.74 ± 1.08 D |
Volume |
481.32 Å 3 |
Surface Area |
410.33 Å 2 |
HOMO Energy |
-9.15 ± 0.55 eV |
LUMO Energy |
1.59 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-[(e)-3-(1h-benzimidazol-2-yl)-1-oxoprop-2-enyl]-6-chloro-4-phenyl-1h-quinolin-2-one
- 3-[(e)-3-(1h-benzimidazol-2-yl)acryloyl]-6-chloro-4-phenyl-carbostyril
- 3-[3-(1h-benzimidazol-2-yl)-1-oxoprop-2-enyl]-6-chloro-4-phenyl-1h-quinolin-2-one
- 3-[3-(1h-benzimidazol-2-yl)acryloyl]-6-chloro-4-phenyl-carbostyril
- 3-[3-(1h-benzimidazol-2-yl)prop-2-enoyl]-6-chloro-4-phenyl-1h-quinolin-2-one
- bim-0034205.p001
- cbmicro_034066
- compound 2
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InChIKey |
SBOKKVUBLNZTCT-OUKQBFOZSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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