Geometry & MOs

Info

ID:	281804
PubChem CID:	103914390
Reduced:	ON3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	235.124215
ΔH_f, kcal/mol:	-32.99
Dipole, Da:	5.32
IP(EA), eV:	-9.03(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-[(2-methylsulfonylcyclopentyl)amino]butan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NC=CN1C)N[C@@H](C)CO

DOS

IR

Vibrations