Geometry & MOs

Info

ID:	345036
PubChem CID:	127268796
Reduced:	NSO3C13H25 (1)
Stoich.:	ABC3D13E25 (1)
Weight, g/mol:	374.097014
ΔH_f, kcal/mol:	-164.35
Dipole, Da:	3.31
IP(EA), eV:	-9.77(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-cyclopropyl-1-N-(oxan-2-ylmethyl)benzene-1,3-disulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CS(=O)(=O)NCC2CCCCO2

DOS

IR

Vibrations