Geometry & MOs

Info

ID:	27345
PubChem CID:	820825
Reduced:	O3C16H16 (1)
Stoich.:	A3B16C16 (1)
Weight, g/mol:	340.188589
ΔH_f, kcal/mol:	-77.49
Dipole, Da:	5.27
IP(EA), eV:	-9.16(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OC

DOS

IR

Vibrations