Geometry & MOs

Info

ID:	278118
PubChem CID:	103833542
Reduced:	FNSO5C13H18 (1)
Stoich.:	ABCD5E13F18 (1)
Weight, g/mol:	325.04425
ΔH_f, kcal/mol:	-229.66
Dipole, Da:	7.25
IP(EA), eV:	-9.74(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3-methylthiophen-2-yl)methylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC(CNS(=O)(=O)C1=C(C=CC(=C1)F)C(=O)OC)COC

DOS

IR

Vibrations