Geometry & MOs

Info

ID:	325226
PubChem CID:	126682131
Reduced:	NO5C7H11 (1)
Stoich.:	AB5C7D11 (1)
Weight, g/mol:	390.162964
ΔH_f, kcal/mol:	-162.77
Dipole, Da:	2.07
IP(EA), eV:	-10.04(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclohexyl-3-ethyl-3-methyl-5-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]oxolan-2-one

Drug info:

PubChemData

Smile

CCOC(=O)/C(=N\OC)/OC(=O)C

DOS

IR

Vibrations