Geometry & MOs

Info

ID:	278140
PubChem CID:	103833684
Reduced:	NSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	303.0599
ΔH_f, kcal/mol:	-130.29
Dipole, Da:	4.81
IP(EA), eV:	-9.79(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-methylsulfanylpropan-2-ylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1S(=O)(=O)NCCCC2CC2

DOS

IR

Vibrations