Geometry & MOs

Info

ID:	28007
PubChem CID:	824802
Reduced:	NOH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	225.090212
ΔH_f, kcal/mol:	7.96
Dipole, Da:	4.33
IP(EA), eV:	-8.86(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-phenyl-1,2-dihydropyrazolo[3,4-b]pyridin-3-one

Drug info:

PubChemData

Smile

CC1(CC2=CC=CC=C2C(=N1)C3=C(N=C(O3)C4=CC=CC=C4)O)C

DOS

IR

Vibrations