Geometry & MOs

Info

ID:	446185
PubChem CID:	135273008
Reduced:	ON8C28H30 (1)
Stoich.:	AB8C28D30 (1)
Weight, g/mol:	279.148396
ΔH_f, kcal/mol:	119.31
Dipole, Da:	10.51
IP(EA), eV:	-9.28(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6E,7E)-6,7-di(ethylidene)-4-N-phenyl-1H-pyrazolo[4,3-c]pyridine-3,4-diamine

Drug info:

PubChemData

Smile

C[C@@H](C1CCCCC1)C2=CC=CC(=N2)CN3C=C(N=N3)C4=NC(=NC(=C4)C5=CC=CC(=C5OC)C#N)N

DOS

IR

Vibrations