Geometry & MOs

Info

ID:

433517

PubChem CID:

135173655

Reduced:

SN2O6C26H32 (1)

Stoich.:

AB2C6D26E32 (1)

Weight, g/mol:

692.259462

ΔHf, kcal/mol:

-138.43

Dipole, Da:

11.09

IP(EA), eV:

 -9.33(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(2,6-dioxopiperidin-3-yl)-5-[2-[2-[3-[4-[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]-3-pyridin-4-ylpyrazol-1-yl]propoxy]ethoxy]ethoxy]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CN(CCOC)S(=O)(=O)C1=CC=C(C=C1)CO/C(=C/OCCN2CC3=CC=CC=C3C2)/C(=O)C=C

DOS

IR

Vibrations