Geometry & MOs

Info

ID:	263767
PubChem CID:	103396542
Reduced:	FOBr3H10C14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	271.137242
ΔH_f, kcal/mol:	-36.41
Dipole, Da:	4.18
IP(EA), eV:	-9.42(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(2-fluoro-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroquinoline

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(C2=CC=C(C=C2)Br)Br)Br)F

DOS

IR

Vibrations