Geometry & MOs

Info

ID:	259918
PubChem CID:	103177463
Reduced:	ClN2O3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	304.04226
ΔH_f, kcal/mol:	-103.97
Dipole, Da:	2.4
IP(EA), eV:	-9.91(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-6-[2-(3-methoxypropoxy)ethoxy]-2-methylpyrimidine

Drug info:

PubChemData

Smile

CC1=C(N=CN=C1Cl)OCCOCCCOC

DOS

IR

Vibrations