Geometry & MOs

Info

ID:	190845
PubChem CID:	78067985
Reduced:	O2C19H26 (1)
Stoich.:	A2B19C26 (1)
Weight, g/mol:	214.09938
ΔH_f, kcal/mol:	-72.96
Dipole, Da:	1.38
IP(EA), eV:	-9.59(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxabicyclo[2.2.2]oct-5-en-3-yl(phenyl)methanone

Drug info:

PubChemData

Smile

CC(CCCC(=C)C)CCOC(=O)C=CC1=CC=CC=C1

DOS

IR

Vibrations