Geometry & MOs

Info

ID:	278408
PubChem CID:	103835404
Reduced:	NSCl2O3C12H17 (1)
Stoich.:	ABC2D3E12F17 (1)
Weight, g/mol:	315.114044
ΔH_f, kcal/mol:	-138.39
Dipole, Da:	6.24
IP(EA), eV:	-9.94(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-hydroxy-2-methylpentyl)sulfamoyl]benzoate

Drug info:

PubChemData

Smile

CCCC(C)(CNS(=O)(=O)C1=CC(=C(C=C1)Cl)Cl)O

DOS

IR

Vibrations