Geometry & MOs

Info

ID:	281587
PubChem CID:	103914081
Reduced:	NSO3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	275.155515
ΔH_f, kcal/mol:	-163.16
Dipole, Da:	4.85
IP(EA), eV:	-9.24(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-methylsulfonylcyclopentyl)amino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

C1CCC(C(C1)CO)NC2CCCS(=O)(=O)C2

DOS

IR

Vibrations