Geometry & MOs

Info

ID:	308973
PubChem CID:	126533206
Reduced:	N7H21C23 (1)
Stoich.:	A7B21C23 (1)
Weight, g/mol:	492.173231
ΔH_f, kcal/mol:	184.29
Dipole, Da:	3.25
IP(EA), eV:	-8.71(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-5-(5-cyclohexyloxypyridin-3-yl)-3-(4-thiophen-2-ylpyrrolo[3,2-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[4,3-b]pyridine

Drug info:

PubChemData

Smile

C1CCN(C1)CC2=CC(=CN=C2)C3=CC\4=C(NN/C4=C/5\C=C6C=CN=CC6=N5)N=C3

DOS

IR

Vibrations