Geometry & MOs

Info

ID:	251393
PubChem CID:	103103682
Reduced:	ClON4C11H15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	314.07422
ΔH_f, kcal/mol:	-3.23
Dipole, Da:	0.65
IP(EA), eV:	-9.45(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-bromo-2-tert-butylpyrimidin-4-yl)-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=CC(=NC(=N1)C2CC2)Cl

DOS

IR

Vibrations