Geometry & MOs

Info

ID:	205150
PubChem CID:	80060754
Reduced:	NSO2C10H21 (1)
Stoich.:	ABC2D10E21 (1)
Weight, g/mol:	233.14495
ΔH_f, kcal/mol:	-112.46
Dipole, Da:	5.23
IP(EA), eV:	-9.07(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methylsulfonylcyclohexyl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNCC1CCCC(C1)S(=O)(=O)C

DOS

IR

Vibrations