Geometry & MOs

Info

ID:

448113

PubChem CID:

135288555

Reduced:

FN12C29H29 (1)

Stoich.:

AB12C29D29 (1)

Weight, g/mol:

438.135285

ΔHf, kcal/mol:

211.14

Dipole, Da:

11.84

IP(EA), eV:

 -8.34(-2.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-4-(3-fluoro-5-methoxyphenyl)-2-(5-pyrimidin-5-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=CN=CC(=N6)N7CC(C7)N)NN4)/N=C32)F

DOS

IR

Vibrations