Geometry & MOs

Info

ID:	275329
PubChem CID:	103815228
Reduced:	SN2O3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	279.150429
ΔH_f, kcal/mol:	-97.26
Dipole, Da:	8.22
IP(EA), eV:	-10.07(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(hydroxymethyl)cyclohexyl]-2-propan-2-yloxyethanesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C#N)S(=O)(=O)NC2CCCCC2CO

DOS

IR

Vibrations