Geometry & MOs

Info

ID:	35632
PubChem CID:	7980120
Reduced:	FO2N3H18C24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	350.049191
ΔH_f, kcal/mol:	1.84
Dipole, Da:	4.32
IP(EA), eV:	-8.88(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)sulfanyl-N-(2-methyl-3-nitrophenyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(N2C=CC=CC2=C1/C=N\NC(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations