Geometry & MOs

Info

ID:	449395
PubChem CID:	135298257
Reduced:	BrSN2O3H19C22 (1)
Stoich.:	ABC2D3E19F22 (1)
Weight, g/mol:	667.262363
ΔH_f, kcal/mol:	-41.7
Dipole, Da:	4.56
IP(EA), eV:	-8.88(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-dibenzofuran-4-ylphenyl)-4-(9,9-dimethylfluoren-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Br)C=C2C(C4=NC=C(C=C4)C)O

DOS

IR

Vibrations