Geometry & MOs

Info

ID:	144447
PubChem CID:	53369518
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	-115.23
Dipole, Da:	4.62
IP(EA), eV:	-8.88(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-4-[4-(pyridin-2-ylmethoxy)phenyl]-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one

Drug info:

PubChemData

Smile

CN(C)CCCN1C2=CC=CC=C2C(=O)N(C1=O)CCO

DOS

IR

Vibrations