Geometry & MOs

Info

ID:	182563
PubChem CID:	76907260
Reduced:	SN3O4H11C12 (1)
Stoich.:	AB3C4D11E12 (1)
Weight, g/mol:	272.079707
ΔH_f, kcal/mol:	-74.08
Dipole, Da:	5.49
IP(EA), eV:	-9.16(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[(3-methylfuran-2-carbonyl)amino]pyridin-2-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)S(=O)(=O)NC2=CNN=C2)C=CC(=O)O

DOS

IR

Vibrations