Geometry & MOs

Info

ID:	289226
PubChem CID:	104341027
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	278.149124
ΔH_f, kcal/mol:	26.06
Dipole, Da:	3.77
IP(EA), eV:	-9.0(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-ethyl-2-(methoxymethyl)-4-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCOCC1=NC(=CC(=N1)NC2CC2C3=CC=CC=C3)N

DOS

IR

Vibrations