Geometry & MOs

Info

ID:	210183
PubChem CID:	80771267
Reduced:	ON4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-18.96
Dipole, Da:	1.47
IP(EA), eV:	-8.88(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[2-(4-methoxyphenyl)ethyl]-2-N-propylpyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCC1=C(N=CN=C1NCC2CCCO2)NCC

DOS

IR

Vibrations