Geometry & MOs

Info

ID:	7003
PubChem CID:	70960
Reduced:	O3C8H10 (1)
Stoich.:	A3B8C10 (1)
Weight, g/mol:	154.062994
ΔH_f, kcal/mol:	-117.93
Dipole, Da:	4.38
IP(EA), eV:	-9.9(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-5-oxocyclopenten-1-yl) acetate

Drug info:

PubChemData

Smile

CC1=C(C(=O)CC1)OC(=O)C

DOS

IR

Vibrations