Geometry & MOs

Info

ID:	210838
PubChem CID:	80860111
Reduced:	BrON3C10H16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	241.124883
ΔH_f, kcal/mol:	-25.46
Dipole, Da:	3.98
IP(EA), eV:	-8.79(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-6-(2-methylpropoxy)-2-methylsulfanylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC=C(C(=N1)OCC(C)C)Br

DOS

IR

Vibrations