Geometry & MOs

Info

ID:	206434
PubChem CID:	80250120
Reduced:	SN2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	263.0286
ΔH_f, kcal/mol:	35.09
Dipole, Da:	3.49
IP(EA), eV:	-8.21(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methylthiophen-3-yl)methylsulfamoyl]propanoic acid

Drug info:

PubChemData

Smile

CCC1=C(SC=C1)CNC2CCC3=C2C=CC(=C3)N

DOS

IR

Vibrations