Geometry & MOs

Info

ID:	19735
PubChem CID:	571531
Reduced:	N5O6H9C13 (1)
Stoich.:	A5B6C9D13 (1)
Weight, g/mol:	331.055283
ΔH_f, kcal/mol:	15.71
Dipole, Da:	3.35
IP(EA), eV:	-9.73(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(dihydroxyamino)-2-nitrobenzoyl]iminopyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C(=O)N=NC(=O)C2=C(C=C(C=C2)N(O)O)[N+](=O)[O-]

DOS

IR

Vibrations