Geometry & MOs

Info

ID:	207426
PubChem CID:	80395119
Reduced:	OSC17H32 (1)
Stoich.:	ABC17D32 (1)
Weight, g/mol:	214.139137
ΔH_f, kcal/mol:	-97.0
Dipole, Da:	3.8
IP(EA), eV:	-8.55(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]ethanethiol

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(C2)OCC(CS)C(C)(C)C)C)C

DOS

IR

Vibrations