Geometry & MOs

Info

ID:	344699
PubChem CID:	127268287
Reduced:	NSO3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	311.119129
ΔH_f, kcal/mol:	-158.45
Dipole, Da:	4.37
IP(EA), eV:	-9.94(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-2,3-dihydro-1,4-benzodioxine-5-sulfonamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NS(=O)(=O)CC2CCCO2

DOS

IR

Vibrations