Geometry & MOs

Info

ID:	385801
PubChem CID:	134980006
Reduced:	C11H14 (1)
Stoich.:	A11B14 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	19.68
Dipole, Da:	0.78
IP(EA), eV:	-8.82(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(1Z)-buta-1,3-dienyl]-2-oxocyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

C1CC2C(C1)C3C2C=CC=C3

DOS

IR

Vibrations