Geometry & MOs

Info

ID:	437666
PubChem CID:	135226773
Reduced:	O4C13H20 (1)
Stoich.:	A4B13C20 (1)
Weight, g/mol:	214.102751
ΔH_f, kcal/mol:	-193.07
Dipole, Da:	3.12
IP(EA), eV:	-10.53(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methyl-2-methylsulfanylcyclopentyl) 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC1(CCCCC1C(=O)OC)C

DOS

IR

Vibrations