Geometry & MOs

Info

ID:	173332
PubChem CID:	75624514
Reduced:	N3O3C23H29 (1)
Stoich.:	A3B3C23D29 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	-64.78
Dipole, Da:	1.73
IP(EA), eV:	-9.02(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzamide

Drug info:

PubChemData

Smile

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)N3CCN(CC3)C(C)C(=O)NC4CC4

DOS

IR

Vibrations