Geometry & MOs

Info

ID:	251396
PubChem CID:	103103697
Reduced:	ClON6C9H11 (1)
Stoich.:	ABC6D9E11 (1)
Weight, g/mol:	300.05857
ΔH_f, kcal/mol:	22.07
Dipole, Da:	1.81
IP(EA), eV:	-9.28(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-bromo-2-propan-2-ylpyrimidin-4-yl)-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=NC(=NC2=C1C=NN2)Cl

DOS

IR

Vibrations