Geometry & MOs

Info

ID:	337410
PubChem CID:	127257095
Reduced:	SO2C15H16 (1)
Stoich.:	AB2C15D16 (1)
Weight, g/mol:	296.976565
ΔH_f, kcal/mol:	-52.26
Dipole, Da:	2.61
IP(EA), eV:	-8.86(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-carboxythiophen-3-yl)carbamoyl]thiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CCOC(=O)C2=CSC=C2)C

DOS

IR

Vibrations