Geometry & MOs

Info

ID:	350737
PubChem CID:	127279025
Reduced:	N2O2C15H26 (1)
Stoich.:	A2B2C15D26 (1)
Weight, g/mol:	258.148061
ΔH_f, kcal/mol:	-129.01
Dipole, Da:	0.58
IP(EA), eV:	-9.21(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2-dimethylpyrrolidin-1-yl)-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)CN2CCCCCCC2=O)C

DOS

IR

Vibrations