Geometry & MOs

Info

ID:	324888
PubChem CID:	126678545
Reduced:	NO7C41H59 (1)
Stoich.:	AB7C41D59 (1)
Weight, g/mol:	273.136493
ΔH_f, kcal/mol:	-289.11
Dipole, Da:	2.59
IP(EA), eV:	-8.85(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(dimethylamino)-3-oxatricyclo[3.3.0.02,4]octan-7-yl] benzoate

Drug info:

PubChemData

Smile

CCCCCCCC(=O)OC(C)OC(=O)[C@H](CC1=CC(=C(C=C1)O)O)NC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

DOS

IR

Vibrations