Geometry & MOs

Info

ID:	426935
PubChem CID:	135154609
Reduced:	PO4N7C25H38 (1)
Stoich.:	AB4C7D25E38 (1)
Weight, g/mol:	355.16444
ΔH_f, kcal/mol:	-174.07
Dipole, Da:	4.51
IP(EA), eV:	-8.9(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methyl-1,2-dihydropyrazolo[3,4-b]pyridin-3-one

Drug info:

PubChemData

Smile

CCCOC(=O)C(C)(C)NP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)N[C@@H](C)C3=CC=C(C=C3)C

DOS

IR

Vibrations