Geometry & MOs

Info

ID:	269084
PubChem CID:	103611810
Reduced:	ClSN3O4C11H16 (1)
Stoich.:	ABC3D4E11F16 (1)
Weight, g/mol:	276.187149
ΔH_f, kcal/mol:	-76.13
Dipole, Da:	6.16
IP(EA), eV:	-9.7(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3,3,5-trimethylcyclohexyl)amino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NCCCNCC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

DOS

IR

Vibrations