Geometry & MOs

Info

ID:	183843
PubChem CID:	77078798
Reduced:	F2N2O3C16H22 (1)
Stoich.:	A2B2C3D16E22 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-188.9
Dipole, Da:	4.19
IP(EA), eV:	-9.15(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-methoxyphenyl)piperidine-1-carbonyl]-4,5-dihydro-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

COCC(=O)N1CCCN(CC1)CC2=C(C=CC(=C2F)F)OC

DOS

IR

Vibrations