Geometry & MOs

Info

ID:	297299
PubChem CID:	117614658
Reduced:	NF5H8C13 (1)
Stoich.:	AB5C8D13 (1)
Weight, g/mol:	676.237545
ΔH_f, kcal/mol:	-182.41
Dipole, Da:	2.87
IP(EA), eV:	-8.65(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-6-(1-phenylcarbazol-9-yl)benzene-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2=C(C(=C(C(=C2F)F)F)F)F)N

DOS

IR

Vibrations