Geometry & MOs

Info

ID:	233700
PubChem CID:	92092942
Reduced:	FON5H18C22 (1)
Stoich.:	ABC5D18E22 (1)
Weight, g/mol:	321.122575
ΔH_f, kcal/mol:	46.25
Dipole, Da:	4.5
IP(EA), eV:	-9.32(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-6-oxo-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C2=CC=NC=C2)CNC(=O)CN3C=C(C=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations