Geometry & MOs

Info

ID:

447957

PubChem CID:

135287140

Reduced:

FN12C29H29 (1)

Stoich.:

AB12C29D29 (1)

Weight, g/mol:

413.207642

ΔHf, kcal/mol:

210.98

Dipole, Da:

7.43

IP(EA), eV:

 -8.16(-2.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-(2,3-dimethylimidazol-4-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]-7-piperidin-1-ylimidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CN(C)CCNC1=CC(=CC(=C1)C2=CN=CC3=N/C(=C\4/C5=C(C=CC(=N5)C6=CN=CC(=N6)N7CC(C7)N)NN4)/N=C23)F

DOS

IR

Vibrations