Geometry & MOs

Info

ID:	249515
PubChem CID:	103090162
Reduced:	NOSC7H17 (1)
Stoich.:	ABCD7E17 (1)
Weight, g/mol:	191.134385
ΔH_f, kcal/mol:	-59.59
Dipole, Da:	2.7
IP(EA), eV:	-8.48(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methylsulfanyl-2-(propylamino)pentan-1-ol

Drug info:

PubChemData

Smile

CNC(CCCSC)CO

DOS

IR

Vibrations