Geometry & MOs

Info

ID:

309692

PubChem CID:

126554774

Reduced:

OF2N7H21C27 (1)

Stoich.:

AB2C7D21E27 (1)

Weight, g/mol:

510.1928

ΔHf, kcal/mol:

72.41

Dipole, Da:

6.0

IP(EA), eV:

 -8.74(-2.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[(2Z)-2-[5-[5-[2-(dimethylamino)ethoxy]pyridin-3-yl]-1,2-dihydropyrazolo[4,3-b]pyridin-3-ylidene]imidazo[4,5-c]pyridin-7-yl]-5-fluorophenol

Drug info:

PubChemData

Smile

C1CN(CC1(F)F)CC2=CC(=CN=C2)C3=NC=C4C(=C3)/C(=C/5\C=C6C(=CN=CC6=N5)C7=COC=C7)/NN4

DOS

IR

Vibrations