Geometry & MOs

Info

ID:	309287
PubChem CID:	126542476
Reduced:	FN2O2C13H16 (2)
Stoich.:	AB2C2D13E16 (2)
Weight, g/mol:	1083.595431
ΔH_f, kcal/mol:	-225.72
Dipole, Da:	6.44
IP(EA), eV:	-9.1(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7-bis[2,3-bis(6-butylnaphthalen-2-yl)phenyl]-2-butylisoindole-1,3-dione

Drug info:

PubChemData

Smile

C/C=C/1\CN2C=C(C(=O)C(=C2C(=O)N1C[C@H](C)CNCC(C)C)O)C(=O)NCC3=C(C=C(C=C3)F)F

DOS

IR

Vibrations