2-[4-(Diphenylmethyl)-1-Piperazinyl]Ethyl 5-[(4R,6R)-4,6-Dimethyl-2-Oxido-1,3,2-Dioxaphosphinan-2-Yl]-2,6-Dimethyl-4-(3-Nitrophenyl)Nicotinate
Properties
| Property | Value |
|---|---|
| Formula | C38H43N4O7P |
| IUPAC Name | 2-(4-benzhydrylpiperazin-1-yl)ethyl 5-[(4r,6r)-4,6-dimethyl-2-oxo-1,3,2λ5-dioxaphosphinan-2-yl]-2,6-dimethyl-4-(3-nitrophenyl)pyridin-1-ium-5-ide-3-carboxylate |
| Molecular Mass | 698.744 g·mol−1 |
| Heat of Formation | -781.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.73 ± 1.08 D |
| Volume | 824.16 Å 3 |
| Surface Area | 638.2 Å 2 |
| HOMO Energy | -9.00 ± 0.55 eV |
| LUMO Energy | -1.09 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PFKHLXIJSNUZDT-SVBPBHIXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |