3-{5-[Bis(2-Chloroethyl)Amino]-1-Phenyl-1H-Benzimidazol-2-Yl}Alanine
Properties
| Property | Value |
|---|---|
| Formula | C20H22Cl2N4O2 |
| IUPAC Name | (2s)-2-amino-3-[5-[bis(2-chloroethyl)amino]-1-phenyl-benzimidazol-2-yl]propanoic acid |
| Molecular Mass | 421.320 g·mol−1 |
| Heat of Formation | -165.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.93 ± 1.08 D |
| Volume | 481.24 Å 3 |
| Surface Area | 406.02 Å 2 |
| HOMO Energy | -8.71 ± 0.55 eV |
| LUMO Energy | -0.73 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NMSSNIMMZNQSNV-INIZCTEOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |