Geometry & MOs

Info

ID:	289218
PubChem CID:	104340829
Reduced:	ON4C14H26 (1)
Stoich.:	AB4C14D26 (1)
Weight, g/mol:	306.166746
ΔH_f, kcal/mol:	-43.8
Dipole, Da:	4.77
IP(EA), eV:	-8.69(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-2-(methoxymethyl)-6-N-propyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCCN(C1=NC(=NC(=C1)N)COC)C(C)CC

DOS

IR

Vibrations