Geometry & MOs

Info

ID:	204839
PubChem CID:	80015813
Reduced:	NSF3C11H20 (1)
Stoich.:	ABC3D11E20 (1)
Weight, g/mol:	263.1919
ΔH_f, kcal/mol:	-196.08
Dipole, Da:	2.34
IP(EA), eV:	-8.87(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]pentane-1-thiol

Drug info:

PubChemData

Smile

CC(C)(CN1CCCC(C1)C(F)(F)F)CS

DOS

IR

Vibrations