Geometry & MOs

Info

ID:	207428
PubChem CID:	80395121
Reduced:	OSC9H20 (1)
Stoich.:	ABC9D20 (1)
Weight, g/mol:	218.170437
ΔH_f, kcal/mol:	-81.56
Dipole, Da:	2.43
IP(EA), eV:	-8.94(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-(3-methylbutan-2-yloxymethyl)butane-1-thiol

Drug info:

PubChemData

Smile

CC(C)C(C)OCC(C)CS

DOS

IR

Vibrations