Geometry & MOs

Info

ID:	376613
PubChem CID:	134222634
Reduced:	O4H36C41 (1)
Stoich.:	A4B36C41 (1)
Weight, g/mol:	840.32396
ΔH_f, kcal/mol:	-36.7
Dipole, Da:	2.89
IP(EA), eV:	-8.47(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenoxy-2-[[2-phenoxy-5-(4-phenoxyphenyl)phenyl]-(4-phenylphenyl)methyl]-4-(4-phenoxyphenyl)benzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC(=C(C=C2)OC)C(C3=CC=C(C=C3)C4=CC=CC=C4)C5=C(C=CC(=C5)C6=CC=C(C=C6)CO)CO

DOS

IR

Vibrations