Geometry & MOs

Info

ID:	205144
PubChem CID:	80060571
Reduced:	SN2O2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	247.1606
ΔH_f, kcal/mol:	-82.12
Dipole, Da:	6.14
IP(EA), eV:	-9.52(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-1-(3-methylsulfonylcyclohexyl)propan-1-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1CCCC(C1)C(CC2=CC=CC=N2)N

DOS

IR

Vibrations