Geometry & MOs

Info

ID:	20018
PubChem CID:	576898
Reduced:	O2H9C11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	346.120509
ΔH_f, kcal/mol:	-99.09
Dipole, Da:	0.16
IP(EA), eV:	-8.92(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations