Geometry & MOs

Info

ID:	355842
PubChem CID:	127290694
Reduced:	NSO3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	360.081364
ΔH_f, kcal/mol:	-116.91
Dipole, Da:	4.59
IP(EA), eV:	-9.63(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-cyclopropyl-3-N-(oxan-3-yl)benzene-1,3-disulfonamide

Drug info:

PubChemData

Smile

C1CC(COC1)NS(=O)(=O)C2=CC3=C(CCC3)C=C2

DOS

IR

Vibrations