Geometry & MOs

Info

ID:	398103
PubChem CID:	135031798
Reduced:	O4H14C19 (1)
Stoich.:	A4B14C19 (1)
Weight, g/mol:	383.08975
ΔH_f, kcal/mol:	-75.07
Dipole, Da:	3.76
IP(EA), eV:	-9.82(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)C1(C(=CC(=O)O1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations