Geometry & MOs

Info

ID:	288906
PubChem CID:	104328038
Reduced:	BrFNOC16H17 (1)
Stoich.:	ABCDE16F17 (1)
Weight, g/mol:	233.132826
ΔH_f, kcal/mol:	-46.31
Dipole, Da:	3.82
IP(EA), eV:	-8.98(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluoro-2-methylphenyl)-2-(1H-imidazol-2-yl)-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(C2=C(C=CC(=C2)Br)OC)NC

DOS

IR

Vibrations