Geometry & MOs

Info

ID:	275324
PubChem CID:	103815192
Reduced:	FSN2O3C14H17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	308.119464
ΔH_f, kcal/mol:	-133.09
Dipole, Da:	4.33
IP(EA), eV:	-10.31(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyanomethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)CO)NS(=O)(=O)C2=CC(=C(C=C2)F)C#N

DOS

IR

Vibrations