Geometry & MOs

Info

ID:	288251
PubChem CID:	104314395
Reduced:	FOBr2N2H11C13 (1)
Stoich.:	ABC2D2E11F13 (1)
Weight, g/mol:	359.94082
ΔH_f, kcal/mol:	-22.15
Dipole, Da:	2.93
IP(EA), eV:	-8.95(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-2-(1-methylimidazol-2-yl)ethanamine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)F)C(C2=C(C=C(C=N2)Br)Br)N

DOS

IR

Vibrations