Geometry & MOs

Info

ID:

433566

PubChem CID:

135173706

Reduced:

ON7C42H47 (1)

Stoich.:

AB7C42D47 (1)

Weight, g/mol:

712.264548

ΔHf, kcal/mol:

92.62

Dipole, Da:

5.09

IP(EA), eV:

 -8.09(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[6-[2-[2-[4-[4-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-3-pyridin-4-ylpyrazol-1-yl]phenoxy]ethoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione

Drug info:

PubChemData

Smile

C/C=C\C1=C(N=CC(=C1)CN2CCC(C2)O)C(=C)NC3=CC=CC(=C3C)C4=C(C(=CC=C4)NC5=NC=CC6=CC(=CN=C65)CN7CCCC7)C

DOS

IR

Vibrations