Geometry & MOs

Info

ID:	219052
PubChem CID:	85090414
Reduced:	O12C27H28 (1)
Stoich.:	A12B27C28 (1)
Weight, g/mol:	544.199822
ΔH_f, kcal/mol:	-467.94
Dipole, Da:	4.69
IP(EA), eV:	-8.86(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-benzoyloxy-5-(4,5-diphenylimidazol-1-yl)oxolan-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations