| Formula |
C15H14IN3O3 |
| IUPAC Name |
ethyl 7-iodo-5-methyl-6-oxo-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate |
| Molecular Mass |
411.194 g·mol−1 |
| Heat of Formation |
-170.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.89 ± 1.08 D |
| Volume |
367.85 Å 3 |
| Surface Area |
322.69 Å 2 |
| HOMO Energy |
-9.01 ± 0.55 eV |
| LUMO Energy |
1.76 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 7-iodo-5-methyl-6-oxo-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
- 7-iodo-6-keto-5-methyl-4h-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
|
| InChIKey |
FRIZVHMAECRUBR-UHFFFAOYSA-N |
| QR Code |
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| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
I
H
C
O
N
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