2-(1,1-Dioxido-3-Oxo-1,2-Benzothiazol-2(3H)-Yl)Ethyl Tetrahydro-2H-Pyran-2-Ylmethyl 2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydro-3,5-Pyridinedicarboxylate
Properties
| Property | Value |
|---|---|
| Formula | C30H31N3O10S |
| IUPAC Name | o5-[[(2r)-tetrahydropyran-2-yl]methyl] o3-[2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl] (4s)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Mass | 625.646 g·mol−1 |
| Heat of Formation | -1174.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.15 ± 1.08 D |
| Volume | 692.86 Å 3 |
| Surface Area | 571.06 Å 2 |
| HOMO Energy | -9.01 ± 0.55 eV |
| LUMO Energy | 1.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SOOCCEZHZUEQKC-AJTFRIOCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |