Geometry & MOs

Info

ID:	366898
PubChem CID:	127321807
Reduced:	NSO3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	207.162314
ΔH_f, kcal/mol:	-141.05
Dipole, Da:	8.66
IP(EA), eV:	-9.59(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-azaspiro[5.5]undec-9-en-2-yl)propan-1-one

Drug info:

PubChemData

Smile

C1CC2(CCC=CC2)CN(C1)C(=O)C3CCS(=O)(=O)C3

DOS

IR

Vibrations