Geometry & MOs

Info

ID:	273907
PubChem CID:	103805781
Reduced:	ON2F3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	248.119464
ΔH_f, kcal/mol:	-253.72
Dipole, Da:	5.32
IP(EA), eV:	-9.34(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-aminocyclohexyl]-2-methylsulfonylpropanamide

Drug info:

PubChemData

Smile

C1CC[C@H]([C@@H](C1)N)NC(=O)C2CCCC(C2)C(F)(F)F

DOS

IR

Vibrations