Geometry & MOs

Info

ID:	251389
PubChem CID:	103103652
Reduced:	BrOSN4C6H9 (1)
Stoich.:	ABCD4E6F9 (1)
Weight, g/mol:	256.109089
ΔH_f, kcal/mol:	4.49
Dipole, Da:	2.9
IP(EA), eV:	-9.25(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=NN=C(S1)Br

DOS

IR

Vibrations