Geometry & MOs

Info

ID:	288284
PubChem CID:	104314611
Reduced:	FN2Br3H10C13 (1)
Stoich.:	AB2C3D10E13 (1)
Weight, g/mol:	405.93148
ΔH_f, kcal/mol:	20.23
Dipole, Da:	2.08
IP(EA), eV:	-9.49(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(2,5-difluorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations