4-(4-Carbamoylphenyl)-N,N-Bis(2-Hydroxy-2-Phenylethyl)-2-Butanaminium
Properties
Property | Value |
---|---|
Formula | C27H32N2O3 |
IUPAC Name | 4-[(3s)-3-[[(2r)-2-hydroxy-2-phenyl-ethyl]-[(2s)-2-hydroxy-2-phenyl-ethyl]amino]butyl]benzamide |
Molecular Mass | 432.555 g·mol−1 |
Heat of Formation | -357.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.34 ± 1.08 D |
Volume | 554.1 Å 3 |
Surface Area | 445.7 Å 2 |
HOMO Energy | -9.05 ± 0.55 eV |
LUMO Energy | -0.36 ± eV |
Point Group Symmetry | C1 |
InChIKey | OPPQEWZOPDBGAS-YMSRPXOMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |