Geometry & MOs

Info

ID:	288248
PubChem CID:	104314380
Reduced:	ON2Br3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	343.90952
ΔH_f, kcal/mol:	18.89
Dipole, Da:	0.97
IP(EA), eV:	-8.84(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dibromopyridin-2-yl)-pyrimidin-5-ylmethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations