Geometry & MOs

Info

ID:	249308
PubChem CID:	103088473
Reduced:	SN2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	191.134385
ΔH_f, kcal/mol:	-30.41
Dipole, Da:	2.6
IP(EA), eV:	-8.52(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-methylsulfanylbutylamino)butan-1-ol

Drug info:

PubChemData

Smile

CN1CCC(CC1)CCNCCCCSC

DOS

IR

Vibrations