Geometry & MOs

Info

ID:	265349
PubChem CID:	103517883
Reduced:	BrFN3C13H13 (1)
Stoich.:	ABC3D13E13 (1)
Weight, g/mol:	271.03202
ΔH_f, kcal/mol:	7.08
Dipole, Da:	4.54
IP(EA), eV:	-8.86(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-amino-5-bromopyridin-4-yl)-cyclopropylamino]ethanol

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)NC2=C(C=NC=C2N)Br

DOS

IR

Vibrations