Geometry & MOs

Info

ID:	396122
PubChem CID:	135027487
Reduced:	N3O5H25C28 (1)
Stoich.:	A3B5C25D28 (1)
Weight, g/mol:	432.99566
ΔH_f, kcal/mol:	-113.74
Dipole, Da:	6.16
IP(EA), eV:	-8.39(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CC4=C(C=C(N3C=O)C(=O)OC)C5=CC=CC=C5N4

DOS

IR

Vibrations