Geometry & MOs

Info

ID:	424136
PubChem CID:	135121457
Reduced:	ON3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	278.03863
ΔH_f, kcal/mol:	61.14
Dipole, Da:	5.3
IP(EA), eV:	-9.31(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-diamino-4-oxobutane-1,1,2,2-tetracarboxylic acid

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2C(=COC(=C2C#N)N)C#N

DOS

IR

Vibrations