Geometry & MOs

Info

ID:	413147
PubChem CID:	135086091
Reduced:	FO3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	364.216908
ΔH_f, kcal/mol:	-162.38
Dipole, Da:	2.23
IP(EA), eV:	-10.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4S)-4-chloro-2-cyclohexyl-6-(4-phenylmethoxybutyl)oxane

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OCC(=O)C1=CC=C(C=C1)F

DOS

IR

Vibrations