Geometry & MOs

Info

ID:	275327
PubChem CID:	103815211
Reduced:	NSF2O3C13H17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	311.119129
ΔH_f, kcal/mol:	-214.69
Dipole, Da:	3.02
IP(EA), eV:	-10.06(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C(C1)CO)NS(=O)(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations