Geometry & MOs

Info

ID:	7887
PubChem CID:	74398
Reduced:	O9C20H22 (1)
Stoich.:	A9B20C22 (1)
Weight, g/mol:	406.126382
ΔH_f, kcal/mol:	-285.12
Dipole, Da:	2.78
IP(EA), eV:	-8.57(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4,5-trimethoxybenzoyl) 3,4,5-trimethoxybenzoate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)C(=O)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC

DOS

IR

Vibrations