Geometry & MOs

Info

ID:	294018
PubChem CID:	117422370
Reduced:	NSO2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	267.1293
ΔH_f, kcal/mol:	-84.86
Dipole, Da:	5.16
IP(EA), eV:	-8.88(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-5-methylsulfonylphenyl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=CC=C(C=C1)CC2CCCNC2

DOS

IR

Vibrations