Geometry & MOs

Info

ID:	395736
PubChem CID:	135026403
Reduced:	NOH19C25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	358.03571
ΔH_f, kcal/mol:	194.45
Dipole, Da:	4.2
IP(EA), eV:	-8.94(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-2-bromo-2-phenylethenyl]-2-(2-phenylethynyl)benzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=NC2=CC=CC=C2)C=C3C4C3C5C6=CC=CC=C6C4O5

DOS

IR

Vibrations