Geometry & MOs

Info

ID:	130263
PubChem CID:	51075428
Reduced:	FON3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	334.038816
ΔH_f, kcal/mol:	-8.47
Dipole, Da:	2.37
IP(EA), eV:	-9.39(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dichlorophenyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NOC(=N2)CN3CCCC3)F

DOS

IR

Vibrations