Geometry & MOs

Info

ID:	261582
PubChem CID:	103241462
Reduced:	N3O3C8H11 (1)
Stoich.:	A3B3C8D11 (1)
Weight, g/mol:	209.116427
ΔH_f, kcal/mol:	-52.87
Dipole, Da:	3.05
IP(EA), eV:	-9.45(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-methylpiperidin-4-yl)oxy-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN/C=C/C(=O)OC

DOS

IR

Vibrations