Geometry & MOs

Info

ID:	251392
PubChem CID:	103103679
Reduced:	ClON5C8H12 (1)
Stoich.:	ABC5D8E12 (1)
Weight, g/mol:	254.093439
ΔH_f, kcal/mol:	-20.75
Dipole, Da:	2.4
IP(EA), eV:	-9.34(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations