Geometry & MOs

Info

ID:	442609
PubChem CID:	135253307
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	348.99814
ΔH_f, kcal/mol:	14.81
Dipole, Da:	3.47
IP(EA), eV:	-8.12(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-4-chloro-5-ethyl-3-methylpyrazolo[3,4-b]pyridine

Drug info:

PubChemData

Smile

CCC(=CNC1=CC(=NN1C2=CC=C(C=C2)OC)C)CC

DOS

IR

Vibrations