Geometry & MOs

Info

ID:	221414
PubChem CID:	85272560
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	246.110978
ΔH_f, kcal/mol:	-101.02
Dipole, Da:	3.14
IP(EA), eV:	-8.36(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-(2-trimethylsilyloxycyclohexyl) ethanethioate

Drug info:

PubChemData

Smile

CC1=C2C3C(CCCO3)C(OC2=C(C=C1)C)(C)C

DOS

IR

Vibrations