Geometry & MOs

Info

ID:	394339
PubChem CID:	135022785
Reduced:	OSiC19H34 (1)
Stoich.:	ABC19D34 (1)
Weight, g/mol:	226.19328
ΔH_f, kcal/mol:	-58.37
Dipole, Da:	1.35
IP(EA), eV:	-9.64(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1S,2S)-2-butyl-1-methylcyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCCC[C@@H](C=C)OC(CCC=C)C#C[Si](C)(C)C

DOS

IR

Vibrations