Geometry & MOs

Info

ID:	384584
PubChem CID:	134977258
Reduced:	O2H20C25 (1)
Stoich.:	A2B20C25 (1)
Weight, g/mol:	254.094294
ΔH_f, kcal/mol:	25.1
Dipole, Da:	4.88
IP(EA), eV:	-9.44(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-5-phenylmethoxybicyclo[4.2.0]octa-1(6),2,4-trien-7-one

Drug info:

PubChemData

Smile

CC(C1=C(C(=C(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)O

DOS

IR

Vibrations