Geometry & MOs

Info

ID:	247746
PubChem CID:	103073081
Reduced:	ON4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	-9.29
Dipole, Da:	6.95
IP(EA), eV:	-8.76(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(aminomethyl)prop-2-enyl]-5-(4-methoxypiperidin-1-yl)pyridazin-3-one

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C(=O)C=C(C=N1)N(CC)CC

DOS

IR

Vibrations