Geometry & MOs

Info

ID:	265442
PubChem CID:	103521354
Reduced:	NSO3C14H29 (1)
Stoich.:	ABC3D14E29 (1)
Weight, g/mol:	317.202465
ΔH_f, kcal/mol:	-182.87
Dipole, Da:	5.86
IP(EA), eV:	-9.84(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3,3-dimethylbutylsulfonyl)pyrrolidin-2-yl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)CCS(=O)(=O)NCC1CCCCC1CO

DOS

IR

Vibrations