Geometry & MOs

Info

ID:	422770
PubChem CID:	135118381
Reduced:	O2N3C23H27 (1)
Stoich.:	A2B3C23D27 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-52.34
Dipole, Da:	7.38
IP(EA), eV:	-7.9(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-ethoxy-4-methoxy-5-prop-2-enylphenyl)methyl-[(2-methyl-1H-imidazol-5-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)C)C)CC(=O)N3C[C@H]([C@@H](C3)O)CC4=CC=NC=C4

DOS

IR

Vibrations