Geometry & MOs

Info

ID:	352918
PubChem CID:	127284008
Reduced:	N3O3C14H15 (1)
Stoich.:	A3B3C14D15 (1)
Weight, g/mol:	233.116427
ΔH_f, kcal/mol:	-70.37
Dipole, Da:	3.87
IP(EA), eV:	-9.2(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-(4-methylidenepiperidine-1-carbonyl)pyridazin-3-one

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)N=CNC2=O)C(=O)N3CCC(=C)CC3

DOS

IR

Vibrations