Geometry & MOs

Info

ID:

448096

PubChem CID:

135288438

Reduced:

FON10H31C32 (1)

Stoich.:

ABC10D31E32 (1)

Weight, g/mol:

532.197137

ΔHf, kcal/mol:

139.15

Dipole, Da:

10.79

IP(EA), eV:

 -8.3(-2.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-4-(1,3-benzodioxol-5-yl)-2-[5-(5-piperidin-4-yloxypyridin-3-yl)-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CN(C)CCNC1=CC(=CC(=C1)C2=NC=CC3=N/C(=C/4\C5=C(C=CC(=N5)C6=CC(=CN=C6)NC(=O)C7CCC7)NN4)/N=C32)F

DOS

IR

Vibrations