Geometry & MOs

Info

ID:	189602
PubChem CID:	77879509
Reduced:	OC5H8 (4)
Stoich.:	AB5C8 (4)
Weight, g/mol:	313.06987
ΔH_f, kcal/mol:	-198.06
Dipole, Da:	1.64
IP(EA), eV:	-9.81(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[5-(2-methylpyridin-4-yl)-2-oxopyridin-3-ylidene]amino]methylidene]propanedioic acid

Drug info:

PubChemData

Smile

CCCCCC(C=CC1C(CC(=O)C1CC(=O)CCC=CC)O)O

DOS

IR

Vibrations