Geometry & MOs

Info

ID:	150880
PubChem CID:	53790577
Reduced:	NO2C10H13 (1)
Stoich.:	AB2C10D13 (1)
Weight, g/mol:	1046.46314
ΔH_f, kcal/mol:	-50.41
Dipole, Da:	1.86
IP(EA), eV:	-8.62(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-bis[2-(4-butylphenyl)-2-[4-[(1,3,3,5-tetramethylcyclohexyl)amino]phenyl]ethenyl]-4,5,6,7-tetrachloro-2-benzofuran-1-one

Drug info:

PubChemData

Smile

CN(C)C1COC2=CC=CC=C2O1

DOS

IR

Vibrations