Geometry & MOs

Info

ID:	251751
PubChem CID:	103106620
Reduced:	O4N5C12H17 (1)
Stoich.:	A4B5C12D17 (1)
Weight, g/mol:	267.169525
ΔH_f, kcal/mol:	-104.14
Dipole, Da:	4.2
IP(EA), eV:	-10.34(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-amino-6-ethoxypyrimidin-4-yl)amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=N1)CC(=O)NC(=O)NC)C2CC2

DOS

IR

Vibrations