Geometry & MOs

Info

ID:	366888
PubChem CID:	127321790
Reduced:	SN2O3C19H32 (1)
Stoich.:	AB2C3D19E32 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-158.86
Dipole, Da:	3.8
IP(EA), eV:	-9.31(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaspiro[5.5]undec-9-en-2-yl-[1-(2-methylpropyl)pyrazolo[3,4-b]pyridin-5-yl]methanone

Drug info:

PubChemData

Smile

CC1CCC(CC1)NS(=O)(=O)CC(=O)N2CCCC3(C2)CCC=CC3

DOS

IR

Vibrations