Geometry & MOs

Info

ID:	273908
PubChem CID:	103805790
Reduced:	SN2O3C10H20 (1)
Stoich.:	AB2C3D10E20 (1)
Weight, g/mol:	268.139862
ΔH_f, kcal/mol:	-160.38
Dipole, Da:	1.75
IP(EA), eV:	-9.32(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-aminocyclohexyl]-3-(2,2,2-trifluoroethoxy)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N[C@@H]1CCCC[C@H]1N)S(=O)(=O)C

DOS

IR

Vibrations