Geometry & MOs

Info

ID:	129780
PubChem CID:	51073827
Reduced:	ClON3H12C14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	347.126991
ΔH_f, kcal/mol:	23.14
Dipole, Da:	7.23
IP(EA), eV:	-9.7(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-methylimidazole-2-carbonyl)phenyl]-2-(4-methylphenyl)-2-oxoacetamide

Drug info:

PubChemData

Smile

C1CCC(C1)(C#N)C(=O)NC2=CC(=C(C=C2)C#N)Cl

DOS

IR

Vibrations