4-(3,4-Dimethoxyphenyl)-N-[2-(3,4-Dimethoxyphenyl)Ethyl]-4-(Isothiocyanatomethyl)-N,5-Dimethyl-1-Hexanamine
Properties
| Property | Value |
|---|---|
| Formula | C28H40N2O4S |
| IUPAC Name | (4s)-n-[2-[3,4-di(methoxy)benzene-5-id-1-yl]ethyl]-4-(3,4-dimethoxyphenyl)-4-(isothiocyanatomethyl)-n,5-dimethyl-hexan-1-amine |
| Molecular Mass | 500.693 g·mol−1 |
| Heat of Formation | -443.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.39 ± 1.08 D |
| Volume | 647.05 Å 3 |
| Surface Area | 481.44 Å 2 |
| HOMO Energy | -8.23 ± 0.55 eV |
| LUMO Energy | 2.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZPHLZPWMGNFCCR-NDEPHWFRSA-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 |