Geometry & MOs

Info

ID:	221531
PubChem CID:	85278802
Reduced:	Si3O8C38H72 (1)
Stoich.:	A3B8C38D72 (1)
Weight, g/mol:	746.324354
ΔH_f, kcal/mol:	-505.94
Dipole, Da:	0.83
IP(EA), eV:	-9.13(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(1,2-ditrityloxyethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OC1CC2C(CO2)(C3C1(C(=O)C(C4=C(C(CC(C3O)(C4(C)C)O)O[Si](CC)(CC)CC)C)O[Si](CC)(CC)CC)C)O

DOS

IR

Vibrations