(6S)-4-(4-Chlorophenyl)-2,3,9-Trimethyl-6-{2-[(2-Methyl-2-Propanyl)Oxy]-2-Oxoethyl}-6,7-Dihydrothieno[3,2-F][1,2,4]Triazolo[4,3-A][1,4]Diazepin-10-Ium
Properties
Property | Value |
---|---|
Formula | C23H26ClN4O2S+ |
IUPAC Name | tert-butyl 2-[(9s)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-8,11,12-triaza-1-azoniatricyclo[8.3.0.02,6]trideca-1(10),2(6),4,7,12-pentaen-9-yl]acetate |
Molecular Mass | 457.996 g·mol−1 |
Heat of Formation | 3284.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.34 ± 1.08 D |
Volume | 458.58 Å 3 |
Surface Area | 386.96 Å 2 |
Point Group Symmetry | C1 |
InChIKey | DNVXATUJJDPFDM-KRWDZBQOSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C N S O Cl |