Geometry & MOs

Info

ID:	395900
PubChem CID:	135026858
Reduced:	N2O2F3H11C13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	379.139287
ΔH_f, kcal/mol:	-219.64
Dipole, Da:	3.37
IP(EA), eV:	-9.88(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C[C@H]2C(=O)NC3=C(C=CC(=C3)C(F)(F)F)C(=O)N2C1

DOS

IR

Vibrations