Geometry & MOs

Info

ID:	403814
PubChem CID:	135061945
Reduced:	O2H22C23 (1)
Stoich.:	A2B22C23 (1)
Weight, g/mol:	368.162374
ΔH_f, kcal/mol:	-0.21
Dipole, Da:	1.47
IP(EA), eV:	-8.57(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl (1R,7R,8S)-7-phenyl-11-oxatricyclo[6.2.1.01,5]undeca-5,9-diene-3,3-dicarboxylate

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)OC(=CC2=CC=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations