Geometry & MOs

Info

ID:

448163

PubChem CID:

135288904

Reduced:

FO2N7H34C35 (1)

Stoich.:

AB2C7D34E35 (1)

Weight, g/mol:

475.200825

ΔHf, kcal/mol:

51.22

Dipole, Da:

12.62

IP(EA), eV:

 -8.36(-1.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-(5-cyclohexyloxypyridin-3-yl)-1,2-dihydroindazol-3-ylidene]-4-(furan-3-yl)pyrrolo[3,2-c]pyridine

Drug info:

PubChemData

Smile

CN(C)CCOC1=CC(=CC(=C1)C2=NC=CC3=N/C(=C\4/C5=C(C=CC(=C5)C6=CC(=CN=C6)NC(=O)C7CCCC7)NN4)/C=C32)F

DOS

IR

Vibrations