Geometry & MOs

Info

ID:	174101
PubChem CID:	75724681
Reduced:	ClN2O4C27H29 (1)
Stoich.:	AB2C4D27E29 (1)
Weight, g/mol:	506.197235
ΔH_f, kcal/mol:	-110.58
Dipole, Da:	1.88
IP(EA), eV:	-8.43(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-N-[2-(cyclohexylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(C1=CC(=C(C=C1)OC)OC)N(C2=CC(=CC=C2)Cl)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations