Geometry & MOs

Info

ID:	35481
PubChem CID:	7979931
Reduced:	ClO3N4H15C18 (1)
Stoich.:	AB3C4D15E18 (1)
Weight, g/mol:	396.087685
ΔH_f, kcal/mol:	-32.17
Dipole, Da:	0.89
IP(EA), eV:	-9.23(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-chloro-2-nitrophenoxy)-N-(2-phenylphenyl)propanamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations