Geometry & MOs

Info

ID:	355830
PubChem CID:	127290682
Reduced:	NSO3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	333.043771
ΔH_f, kcal/mol:	-158.85
Dipole, Da:	5.58
IP(EA), eV:	-9.6(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(oxan-3-yl)-2,3-dihydro-1,4-benzodioxine-7-sulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CS(=O)(=O)NC2CCCOC2

DOS

IR

Vibrations