Geometry & MOs

Info

ID:	50094
PubChem CID:	12012597
Reduced:	BrH13C22 (1)
Stoich.:	AB13C22 (1)
Weight, g/mol:	295.05718
ΔH_f, kcal/mol:	177.58
Dipole, Da:	1.77
IP(EA), eV:	-8.96(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1-hydroxy-2,2,5,5-tetramethyl-4-phenylpyrrole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#CC2=CC(=CC=C2)C#CC3=CC(=CC=C3)Br

DOS

IR

Vibrations