Geometry & MOs

Info

ID:	366850
PubChem CID:	127320538
Reduced:	NSO3C10H19 (1)
Stoich.:	ABC3D10E19 (1)
Weight, g/mol:	287.155515
ΔH_f, kcal/mol:	-155.88
Dipole, Da:	7.43
IP(EA), eV:	-9.78(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylazepan-1-yl)-(1-methylsulfonylcyclopentyl)methanone

Drug info:

PubChemData

Smile

CC1CCCCCN1C(=O)CS(=O)(=O)C

DOS

IR

Vibrations