Geometry & MOs

Info

ID:	83792
PubChem CID:	49861426
Reduced:	BrNOC17H34 (1)
Stoich.:	ABCD17E34 (1)
Weight, g/mol:	336.277678
ΔH_f, kcal/mol:	-123.59
Dipole, Da:	2.85
IP(EA), eV:	-8.65(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-cyclohexylcyclohexyl)-5-piperidin-4-yl-1,2-oxazolidin-3-ol

Drug info:

PubChemData

Smile

CCCCN(CCC)C1CCC2CCCC(C2C1)O.Br

DOS

IR

Vibrations