Geometry & MOs

Info

ID:	270881
PubChem CID:	103638526
Reduced:	SO2F3N3H8C12 (1)
Stoich.:	AB2C3D3E8F12 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-174.77
Dipole, Da:	2.74
IP(EA), eV:	-9.56(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-azaspiro[5.5]undecane-3-carbonyl)-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NC(=O)C2=NNC(=O)C=C2)SC(F)(F)F

DOS

IR

Vibrations