Geometry & MOs

Info

ID:	277485
PubChem CID:	103828905
Reduced:	SN2O3C10H22 (1)
Stoich.:	AB2C3D10E22 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	-147.44
Dipole, Da:	4.16
IP(EA), eV:	-9.61(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-aminocyclohexyl]-5-cyano-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

COCCCS(=O)(=O)N[C@@H]1CCCC[C@H]1N

DOS

IR

Vibrations