Geometry & MOs

Info

ID:	288367
PubChem CID:	104315786
Reduced:	Br2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	334.07931
ΔH_f, kcal/mol:	56.43
Dipole, Da:	5.35
IP(EA), eV:	-8.7(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(5-bromopyridin-2-yl)-4,6-dimethylpyrimidin-5-yl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)C2=C(C=C(C=N2)Br)Br)C)C(C)CNC

DOS

IR

Vibrations