(2Z)-3-[4-(3-{[2-(3,4-Dimethoxyphenyl)Ethyl]Amino}-2-Hydroxypropoxy)Phenyl]-2-Butenenitrile

Molecule SVG Image

Properties Simple | Detailed

Formula C23H28N2O4
IUPAC Name (e)-3-[4-[(2r)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]phenyl]but-2-enenitrile
Molecular Mass 396.479 g·mol−1
Heat of Formation -354.9 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 501.02 Å 3
Surface Area 451.11 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
InChIKey BMAJJBHGPUHERB-OTJDAXFFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N