Geometry & MOs

Info

ID:	211371
PubChem CID:	80940020
Reduced:	Br2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	36.79
Dipole, Da:	4.83
IP(EA), eV:	-8.7(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-ethoxyphenyl)-N-ethyl-2-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)CC)NC2=C(C=C(C=C2)Br)Br

DOS

IR

Vibrations