Geometry & MOs

Info

ID:

380805

PubChem CID:

134971370

Reduced:

FO2H9C10 (2)

Stoich.:

AB2C9D10 (2)

Weight, g/mol:

271.106925

ΔHf, kcal/mol:

-175.95

Dipole, Da:

5.56

IP(EA), eV:

-8.57(-1.08)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[4-(tetrazol-1-yl)butyl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CCOC(=CC(=C(F)F)OCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations