Geometry & MOs

Info

ID:	366907
PubChem CID:	127321832
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	2.66
Dipole, Da:	5.64
IP(EA), eV:	-9.53(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-(1,5-dimethylpyrazol-4-yl)methanone

Drug info:

PubChemData

Smile

C1CC2(CCC=CC2)CN(C1)C(=O)CCC3=NC(=NO3)C4=CC=NC=C4

DOS

IR

Vibrations