Geometry & MOs

Info

ID:	73448
PubChem CID:	48417727
Reduced:	ClOSN3H18C19 (1)
Stoich.:	ABCD3E18F19 (1)
Weight, g/mol:	380.213364
ΔH_f, kcal/mol:	21.89
Dipole, Da:	4.8
IP(EA), eV:	-8.14(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexyl-N-[2-methyl-3-(propylsulfonylamino)phenyl]butanamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C(=O)NC2=CC(=C(C=C2)NC(C)C3=CC=CC=C3)Cl

DOS

IR

Vibrations