Geometry & MOs

Info

ID:	288302
PubChem CID:	104314860
Reduced:	FN2Br3H12C14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	387.9409
ΔH_f, kcal/mol:	11.19
Dipole, Da:	1.59
IP(EA), eV:	-8.35(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dibromopyridin-2-yl)-(4-fluorophenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCNC(C1=C(C=CC(=C1)Br)F)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations