Geometry & MOs

Info

ID:	45503
PubChem CID:	10514257
Reduced:	NO2C15H15 (1)
Stoich.:	AB2C15D15 (1)
Weight, g/mol:	241.088498
ΔH_f, kcal/mol:	3.81
Dipole, Da:	3.0
IP(EA), eV:	-8.84(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(ethylamino)-2-methylsulfanylpyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

C/C(=N\O)/C1=CC=CC=C1OCC2=CC=CC=C2

DOS

IR

Vibrations