Geometry & MOs

Info

ID:	6472
PubChem CID:	68705
Reduced:	NO3C20H37 (1)
Stoich.:	AB3C20D37 (1)
Weight, g/mol:	339.277344
ΔH_f, kcal/mol:	-199.56
Dipole, Da:	2.96
IP(EA), eV:	-8.67(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(diethylamino)propan-2-yl (2S)-2-cyclohexyl-2-hydroxycyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)CC(C)OC(=O)C1CCCC[C@@]1(C2CCCCC2)O

DOS

IR

Vibrations