Geometry & MOs

Info

ID:

403846

PubChem CID:

135062140

Reduced:

SiO2C16H28 (1)

Stoich.:

AB2C16D28 (1)

Weight, g/mol:

260.141245

ΔHf, kcal/mol:

-151.49

Dipole, Da:

4.34

IP(EA), eV:

-8.91(-0.09)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3-butyl-5-methoxy-1H-inden-1-yl) acetate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC1CC(=O)C2=C1CCCC2

DOS

IR

Vibrations