Geometry & MOs

Info

ID:	202888
PubChem CID:	79739613
Reduced:	BrFON2C12H16 (1)
Stoich.:	ABCD2E12F16 (1)
Weight, g/mol:	316.05865
ΔH_f, kcal/mol:	-62.88
Dipole, Da:	2.21
IP(EA), eV:	-8.66(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-fluorophenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine

Drug info:

PubChemData

Smile

CN1CCOC(C1)C(C2=C(C=CC(=C2)Br)F)N

DOS

IR

Vibrations