Geometry & MOs

Info

ID:	252459
PubChem CID:	103111529
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	272.104003
ΔH_f, kcal/mol:	-76.5
Dipole, Da:	4.24
IP(EA), eV:	-10.17(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloro-2-methoxypyrimidin-4-yl)amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCCCCCCCCN1C(=C(N=N1)C(=O)OCC)CN

DOS

IR

Vibrations