Geometry & MOs

Info

ID:	381088
PubChem CID:	134971724
Reduced:	O5C28H29 (2)
Stoich.:	A5B28C29 (2)
Weight, g/mol:	728.313789
ΔH_f, kcal/mol:	-247.05
Dipole, Da:	4.34
IP(EA), eV:	-8.47(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[[3,5-bis(4-methoxyphenyl)phenyl]methoxy]-5-methylbenzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC(=CC(=C2)COCCOCCOC3=CC=C(C=C3)OCCOCCOCC4=CC(=CC(=C4)C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC

DOS

IR

Vibrations