Geometry & MOs

Info

ID:	437662
PubChem CID:	135226769
Reduced:	SO2C15H26 (1)
Stoich.:	AB2C15D26 (1)
Weight, g/mol:	300.13953
ΔH_f, kcal/mol:	-112.9
Dipole, Da:	2.95
IP(EA), eV:	-8.55(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-methoxyethyl)-2-methylsulfanylcarbonylcyclohexyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1(CCCCC1SC)C(C)(C)C

DOS

IR

Vibrations