Geometry & MOs

Info

ID:	215814
PubChem CID:	85085290
Reduced:	O3C8H14 (1)
Stoich.:	A3B8C14 (1)
Weight, g/mol:	158.10955
ΔH_f, kcal/mol:	-127.08
Dipole, Da:	3.55
IP(EA), eV:	-10.08(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylcyclopent-3-en-1-yl)benzene

Drug info:

PubChemData

Smile

CCCOCC=CC(=O)OC

DOS

IR

Vibrations