Geometry & MOs

Info

ID:	231781
PubChem CID:	87574649
Reduced:	ON2C11H12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	107.073499
ΔH_f, kcal/mol:	17.87
Dipole, Da:	5.66
IP(EA), eV:	-8.45(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-azaspiro[2.5]oct-6-yne

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=C)N=C=O

DOS

IR

Vibrations