Geometry & MOs

Info

ID:	289198
PubChem CID:	104339542
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	278.210661
ΔH_f, kcal/mol:	-70.4
Dipole, Da:	3.22
IP(EA), eV:	-8.76(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(1-cyclopropylethyl)-2-(methoxymethyl)-4-N-methyl-6-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)COC)N2CCCC(C2)O

DOS

IR

Vibrations