Geometry & MOs

Info

ID:	251488
PubChem CID:	103104330
Reduced:	ON8C12H18 (1)
Stoich.:	AB8C12D18 (1)
Weight, g/mol:	223.14331
ΔH_f, kcal/mol:	31.28
Dipole, Da:	6.44
IP(EA), eV:	-9.63(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)N(CC)CC(=O)N)N2C=CN=C2

DOS

IR

Vibrations