Geometry & MOs

Info

ID:	29653
PubChem CID:	836182
Reduced:	ClNO2H12C15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	-33.99
Dipole, Da:	2.26
IP(EA), eV:	-9.13(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-3-oxo-N-phenylpentanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)[C@@H](C(=O)NC2=CC=CC=C2)Cl

DOS

IR

Vibrations