(3S)-4-[(1R)-1-(2-Amino-4-Chlorophenyl)Ethyl]-3-(4-Chlorophenyl)-7-Iodo-1-[3-(4-Methyl-1-Piperazinyl)Propyl]-3,4-Dihydro-1H-1,4-Benzodiazepine-2,5-Dione
Properties
| Property | Value |
|---|---|
| Formula | C31H34Cl2IN5O2 |
| IUPAC Name | 2-[3-[3-[2-(chloromethyl)-3-methylene-cyclopropen-1-yl]-4-ethyl-7-iodo-2,5-dioxo-3h-1,4-benzodiazepin-1-yl]prop-2-ynyl-ethynyl-amino]ethynyl-methylidyne-ammonium; 3-chloroprop-2-ynenitrile |
| Molecular Mass | 706.444 g·mol−1 |
| Heat of Formation | -71.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.65 ± 1.08 D |
| Volume | 717.12 Å 3 |
| Surface Area | 503.66 Å 2 |
| HOMO Energy | -8.59 ± 0.55 eV |
| LUMO Energy | 2.07 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NUKCQDDVORQLDB-OLILMLBXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl I H O N |