Geometry & MOs

Info

ID:	332254
PubChem CID:	127250540
Reduced:	FO3N4H21C22 (1)
Stoich.:	AB3C4D21E22 (1)
Weight, g/mol:	426.150347
ΔH_f, kcal/mol:	-77.73
Dipole, Da:	3.51
IP(EA), eV:	-9.37(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-[6-(2,6-difluorophenyl)pyridin-2-yl]morpholin-4-yl]-2-oxoethyl]-6-methylpyridazin-3-one

Drug info:

PubChemData

Smile

CC1=NN(C(=O)C=C1)CC(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)F

DOS

IR

Vibrations