Geometry & MOs

Info

ID:	225127
PubChem CID:	85741897
Reduced:	NOPC17H18 (1)
Stoich.:	ABCD17E18 (1)
Weight, g/mol:	294.00556
ΔH_f, kcal/mol:	3.49
Dipole, Da:	4.48
IP(EA), eV:	-8.92(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-fluoro-1-[4-(methoxymethyl)phenyl]benzene

Drug info:

PubChemData

Smile

C1CN(CC1PC2=CC=CC=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations