Geometry & MOs

Info

ID:	268012
PubChem CID:	103595521
Reduced:	NOSC13H27 (1)
Stoich.:	ABCD13E27 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-89.28
Dipole, Da:	2.87
IP(EA), eV:	-8.54(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylpyridin-3-yl)-(4-methylthiomorpholin-3-yl)methanol

Drug info:

PubChemData

Smile

CCCCCCCC(C1CSCCN1C)O

DOS

IR

Vibrations