5-(2-Chlorophenyl)-3-Methyl-7-Nitropyrazolo[3,4-B][1,4]Benzodiazepine
Properties
| Property | Value |
|---|---|
| Formula | C17H10ClN5O2 |
| IUPAC Name | 5-(2-chlorophenyl)-3-methyl-7-nitro-pyrazolo[3,4-b][1,4]benzodiazepine |
| Molecular Mass | 351.747 g·mol−1 |
| Heat of Formation | 2213.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.53 ± 1.08 D |
| Volume | 340.74 Å 3 |
| Surface Area | 295.54 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -2.87 ± eV |
| Point Group Symmetry | Cs |
| InChIKey | NKUOWCWVEBHJCR-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl O N |