Geometry & MOs

Info

ID:	290342
PubChem CID:	104430614
Reduced:	ON3C6H11 (2)
Stoich.:	AB3C6D11 (2)
Weight, g/mol:	281.185175
ΔH_f, kcal/mol:	-72.49
Dipole, Da:	4.54
IP(EA), eV:	-9.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(ethylamino)-5-methylpyrimidin-4-yl]amino]-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CCCOC1=NC(=NC(=N1)NCCC(=O)NC(C)C)N

DOS

IR

Vibrations