Geometry & MOs

Info

ID:	442623
PubChem CID:	135253410
Reduced:	N5O5C24H29 (1)
Stoich.:	A5B5C24D29 (1)
Weight, g/mol:	405.135638
ΔH_f, kcal/mol:	-123.02
Dipole, Da:	10.62
IP(EA), eV:	-9.03(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(4-ethylphenyl)-3-methyl-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C(=CNC1=CC(=NN1CC2=CN(C=N2)CC3=CC=C(C=C3)OC)C)C(=O)OCC

DOS

IR

Vibrations