Geometry & MOs

Info

ID:	366963
PubChem CID:	127322022
Reduced:	O2N5C17H21 (1)
Stoich.:	A2B5C17D21 (1)
Weight, g/mol:	366.241962
ΔH_f, kcal/mol:	1.49
Dipole, Da:	5.18
IP(EA), eV:	-9.29(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-(1-butan-2-yl-6-methylpyrazolo[3,4-b]pyridin-4-yl)methanone

Drug info:

PubChemData

Smile

C1CC2(CCC=CC2)CN(C1)C(=O)CN3C(=O)C4=CC=NN4C=N3

DOS

IR

Vibrations