Geometry & MOs

Info

ID:	275323
PubChem CID:	103815188
Reduced:	ClNSO3C14H20 (1)
Stoich.:	ABCD3E14F20 (1)
Weight, g/mol:	312.094392
ΔH_f, kcal/mol:	-132.08
Dipole, Da:	7.42
IP(EA), eV:	-9.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-4-fluoro-N-[2-(hydroxymethyl)cyclohexyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NC2CCCCC2CO)Cl

DOS

IR

Vibrations