Geometry & MOs

Info

ID:

444175

PubChem CID:

135261594

Reduced:

FSN6H21C26 (1)

Stoich.:

ABC6D21E26 (1)

Weight, g/mol:

486.228043

ΔHf, kcal/mol:

158.82

Dipole, Da:

5.16

IP(EA), eV:

 -8.42(-1.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3Z)-5-[5-(piperidin-1-ylmethyl)pyridin-3-yl]-3-(4-pyridin-3-ylpyrrolo[3,2-c]pyridin-2-ylidene)-1,2-dihydropyrazolo[3,4-c]pyridine

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CN=C1)C2=CC\3=C(NN/C3=C\4/C=C5C(=N4)C=CC=C5C6=CC=C(S6)F)N=C2

DOS

IR

Vibrations