Geometry & MOs

Info

ID:	278259
PubChem CID:	103834425
Reduced:	NSO3C14H23 (1)
Stoich.:	ABC3D14E23 (1)
Weight, g/mol:	321.070465
ΔH_f, kcal/mol:	-144.64
Dipole, Da:	5.68
IP(EA), eV:	-9.68(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(2-hydroxy-4-methylpentyl)sulfamoyl]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NCC(CC(C)C)O)C

DOS

IR

Vibrations