Geometry & MOs

Info

ID:	398107
PubChem CID:	135031808
Reduced:	FO2N7H14C17 (1)
Stoich.:	AB2C7D14E17 (1)
Weight, g/mol:	349.128723
ΔH_f, kcal/mol:	33.31
Dipole, Da:	7.86
IP(EA), eV:	-9.23(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-diamino-6-nitro-5-phenyl-5,7,8,9-tetrahydroimidazo[1,2-a][1,8]naphthyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CN2C(=C(C(C3=C2N=C(C(=C3N)C#N)N)C4=CC=C(C=C4)F)[N+](=O)[O-])N1

DOS

IR

Vibrations