Geometry & MOs

Info

ID:	445491
PubChem CID:	135267379
Reduced:	NOC9H11 (1)
Stoich.:	ABC9D11 (1)
Weight, g/mol:	470.162187
ΔH_f, kcal/mol:	25.1
Dipole, Da:	3.47
IP(EA), eV:	-9.01(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-chloro-8-[(2Z)-5,5-diaminopenta-2,4-dien-2-yl]-9-oxopyrido[3,2-h][1,6]naphthyridin-10-yl]phenyl]-2-methylpropanenitrile

Drug info:

PubChemData

Smile

CC1C=CC=C2[C@@]1(ON=C2)C

DOS

IR

Vibrations