Geometry & MOs

Info

ID:	17476
PubChem CID:	500471
Reduced:	BrOH11C15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	285.99933
ΔH_f, kcal/mol:	23.41
Dipole, Da:	1.01
IP(EA), eV:	-8.64(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromophenyl)-2H-chromene

Drug info:

PubChemData

Smile

C1C(=CC2=CC=CC=C2O1)C3=CC=C(C=C3)Br

DOS

IR

Vibrations