(2S)-3-[2-(3,4-Dimethoxyphenyl)-1,3-Dithian-2-Yl]-N-[2-(3,4-Dimethoxyphenyl)Ethyl]-N,2-Dimethyl-1-Propanamine
Properties
Property | Value |
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Formula | C27H39NO4S2 |
IUPAC Name | (2s)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-n-[2-(3,4-dimethoxyphenyl)ethyl]-n,2-dimethyl-propan-1-amine |
Molecular Mass | 505.733 g·mol−1 |
Heat of Formation | -527.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.84 ± 1.08 D |
Volume | 626.97 Å 3 |
Surface Area | 459.89 Å 2 |
HOMO Energy | -8.11 ± 0.55 eV |
LUMO Energy | 2.91 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | MVSRAALPTQIRFB-FQEVSTJZSA-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 |