Geometry & MOs

Info

ID:	22266
PubChem CID:	596456
Reduced:	NO3C25H25 (1)
Stoich.:	AB3C25D25 (1)
Weight, g/mol:	387.183444
ΔH_f, kcal/mol:	-38.72
Dipole, Da:	4.3
IP(EA), eV:	-8.2(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dimethoxyphenyl)ethyl]-3,3-diphenylprop-2-enamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNC(=O)C=C(C2=CC=CC=C2)C3=CC=CC=C3)OC

DOS

IR

Vibrations