Geometry & MOs

Info

ID:	366892
PubChem CID:	127321794
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	324.195011
ΔH_f, kcal/mol:	-0.89
Dipole, Da:	6.62
IP(EA), eV:	-8.79(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN=NN1C(CC2=CC(=CC=C2)OC)C(=O)N3CCCC4(C3)CCC=CC4

DOS

IR

Vibrations