Geometry & MOs

Info

ID:	341410
PubChem CID:	127264103
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	288.136159
ΔH_f, kcal/mol:	-47.21
Dipole, Da:	4.06
IP(EA), eV:	-9.4(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-oxo-2-(5-oxo-2-propyl-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)acetate

Drug info:

PubChemData

Smile

CCCC1=CC2=C(C=C1)C(=O)CCCC2

DOS

IR

Vibrations