Geometry & MOs

Info

ID:	299479
PubChem CID:	117683283
Reduced:	OC4H5 (6)
Stoich.:	AB4C5 (6)
Weight, g/mol:	668.283277
ΔH_f, kcal/mol:	-234.09
Dipole, Da:	4.26
IP(EA), eV:	-9.97(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[3-[3-hydroxy-2-(4-methoxybenzoyl)oxy-2-methylpropoxy]-2-(4-methoxybenzoyl)oxy-2-methylpropoxy]-2-methylpropan-2-yl] 4-methoxybenzoate

Drug info:

PubChemData

Smile

CCC(C)(COCC(CC)(CO)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations