Geometry & MOs

Info

ID:	85272
PubChem CID:	49873356
Reduced:	O2N3C24H33 (1)
Stoich.:	A2B3C24D33 (1)
Weight, g/mol:	491.232125
ΔH_f, kcal/mol:	-73.57
Dipole, Da:	3.67
IP(EA), eV:	-9.36(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(6-methoxypyridin-3-yl)-1-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]benzo[h][1,6]naphthyridin-2-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=N2

DOS

IR

Vibrations