Geometry & MOs

Info

ID:	273903
PubChem CID:	103805765
Reduced:	ON2C12H20 (1)
Stoich.:	AB2C12D20 (1)
Weight, g/mol:	296.129156
ΔH_f, kcal/mol:	-39.8
Dipole, Da:	5.87
IP(EA), eV:	-8.89(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations