Geometry & MOs

Info

ID:	268796
PubChem CID:	103600969
Reduced:	NSO4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	313.134779
ΔH_f, kcal/mol:	-153.64
Dipole, Da:	6.6
IP(EA), eV:	-9.65(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(5-methylhexan-2-ylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1S(=O)(=O)NCC2CCCCC2

DOS

IR

Vibrations