Geometry & MOs

Info

ID:	43639
PubChem CID:	10321579
Reduced:	FO2N5C25H30 (1)
Stoich.:	AB2C5D25E30 (1)
Weight, g/mol:	451.214744
ΔH_f, kcal/mol:	-35.44
Dipole, Da:	6.4
IP(EA), eV:	-9.08(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dimethoxyphenyl)-1-phenylethyl]-2,2-diphenylacetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC2=NC=CC(=N2)C3=C(ON=C3C4=CC=C(C=C4)F)CN5CCC[C@H]5CO

DOS

IR

Vibrations