Geometry & MOs

Info

ID:	282871
PubChem CID:	103942977
Reduced:	SO2N3C13H19 (1)
Stoich.:	AB2C3D13E19 (1)
Weight, g/mol:	277.117489
ΔH_f, kcal/mol:	-53.89
Dipole, Da:	2.71
IP(EA), eV:	-9.1(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-methyl-2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C(N=C1C)NCCSCC=C

DOS

IR

Vibrations