Geometry & MOs

Info

ID:	289168
PubChem CID:	104338261
Reduced:	O2N4C15H26 (1)
Stoich.:	A2B4C15D26 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-78.01
Dipole, Da:	5.13
IP(EA), eV:	-8.79(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxymethyl)-6-N-ethyl-4-N-(2-methylphenyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC(=N1)COC)N2CCC(CC2)CO

DOS

IR

Vibrations