Geometry & MOs

Info

ID:	283251
PubChem CID:	103967942
Reduced:	OSN2C15H28 (1)
Stoich.:	ABC2D15E28 (1)
Weight, g/mol:	286.189257
ΔH_f, kcal/mol:	-64.37
Dipole, Da:	2.22
IP(EA), eV:	-8.6(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-hydroxy-2-[(3,3,5,5-tetramethylcyclohexyl)carbamoylamino]propanoic acid

Drug info:

PubChemData

Smile

CC(C)C(COC)NC1=NCC2(CCCCC2)CS1

DOS

IR

Vibrations