Geometry & MOs

Info

ID:	366946
PubChem CID:	127321932
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-46.51
Dipole, Da:	5.33
IP(EA), eV:	-9.36(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-azaspiro[5.5]undec-9-ene-2-carbonyl)-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N2CCCC3(C2)CCC=CC3

DOS

IR

Vibrations