Geometry & MOs

Info

ID:	214794
PubChem CID:	85083652
Reduced:	BrSi2O4C30H49 (1)
Stoich.:	AB2C4D30E49 (1)
Weight, g/mol:	610.220283
ΔH_f, kcal/mol:	-303.19
Dipole, Da:	5.53
IP(EA), eV:	-8.99(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4,6-tribenzoyloxy-8-hydroxyoctyl) benzoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1CC2C(C1C=CC(CCC3=CC(=CC=C3)Br)O[Si](C)(C)C(C)(C)C)CC(=O)O2

DOS

IR

Vibrations