Geometry & MOs

Info

ID:	11734
PubChem CID:	120029
Reduced:	O5H14C17 (2)
Stoich.:	A5B14C17 (2)
Weight, g/mol:	596.168247
ΔH_f, kcal/mol:	-288.2
Dipole, Da:	10.61
IP(EA), eV:	-9.15(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[2-(4-benzoyl-3-hydroxyphenoxy)ethyl] but-2-enedioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCOC(=O)C=CC(=O)OCCOC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O)O

DOS

IR

Vibrations