Geometry & MOs

Info

ID:	389405
PubChem CID:	134992728
Reduced:	NO4C13H23 (1)
Stoich.:	AB4C13D23 (1)
Weight, g/mol:	226.156895
ΔH_f, kcal/mol:	-168.29
Dipole, Da:	3.94
IP(EA), eV:	-9.57(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-hydroperoxy-2-(3-methylbut-1-en-2-yl)cyclooctan-1-one

Drug info:

PubChemData

Smile

CC/C=C(/C(=O)OC(C)(C)C)\N(C(=O)C)OCC

DOS

IR

Vibrations