Geometry & MOs

Info

ID:	341407
PubChem CID:	127264100
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	274.120509
ΔH_f, kcal/mol:	-99.42
Dipole, Da:	1.9
IP(EA), eV:	-9.21(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)CCCCC(=O)OC

DOS

IR

Vibrations