Geometry & MOs

Info

ID:	29662
PubChem CID:	836299
Reduced:	ClNO3C12H16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	333.113171
ΔH_f, kcal/mol:	-123.01
Dipole, Da:	7.79
IP(EA), eV:	-8.18(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylbutanamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=CC(=C(C=C1OC)OC)Cl

DOS

IR

Vibrations