Geometry & MOs

Info

ID:	2425
PubChem CID:	7466
Reduced:	BrOH7C8 (1)
Stoich.:	ABC7D8 (1)
Weight, g/mol:	197.96803
ΔH_f, kcal/mol:	-15.61
Dipole, Da:	2.78
IP(EA), eV:	-9.98(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)Br

DOS

IR

Vibrations