Geometry & MOs

Info

ID:	226948
PubChem CID:	87559170
Reduced:	N4O6C21H22 (1)
Stoich.:	A4B6C21D22 (1)
Weight, g/mol:	525.180409
ΔH_f, kcal/mol:	-152.23
Dipole, Da:	6.2
IP(EA), eV:	-9.46(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N=NC2=CC=CC=C2.C1=CC(=O)NC1=O.C(CC(=O)O)[C@@H](C(=O)O)N

DOS

IR

Vibrations