Geometry & MOs

Info

ID:	290764
PubChem CID:	110473190
Reduced:	NO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	253.09636
ΔH_f, kcal/mol:	-80.31
Dipole, Da:	1.53
IP(EA), eV:	-9.26(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)CC(=O)NCC2=CC(=CC=C2)O

DOS

IR

Vibrations