Geometry & MOs

Info

ID:	314320
PubChem CID:	126621344
Reduced:	O7H32C33 (1)
Stoich.:	A7B32C33 (1)
Weight, g/mol:	446.184607
ΔH_f, kcal/mol:	-213.42
Dipole, Da:	3.16
IP(EA), eV:	-8.57(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-difluoro-1-[4-[3-methyl-4-(4-methylphenyl)phenyl]phenyl]-4-phenylbenzene

Drug info:

PubChemData

Smile

CC12COC(OC1)(OC2)C3=CC4=C(C=C3)C(=CC=C4)COC5=CC(=CC6=CC=CC=C65)C78OCC(CO7)(CO8)C

DOS

IR

Vibrations