Geometry & MOs

Info

ID:	391307
PubChem CID:	135004234
Reduced:	N2O4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	349.123342
ΔH_f, kcal/mol:	-193.93
Dipole, Da:	5.43
IP(EA), eV:	-10.56(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-chloroanilino)-1,4-diphenylbutan-2-one

Drug info:

PubChemData

Smile

C1CC2(CCC1CCC(=O)O)C(=O)NC(=O)N2

DOS

IR

Vibrations