Geometry & MOs

Info

ID:	406038
PubChem CID:	135076329
Reduced:	SN2O4H20C24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	293.097127
ΔH_f, kcal/mol:	-52.65
Dipole, Da:	8.0
IP(EA), eV:	-9.21(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-4-chloro-2-phenylaniline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)/C=C(/C2=CC=C(C=C2)C#N)\C3=CC=C(C=C3)OC

DOS

IR

Vibrations