Geometry & MOs

Info

ID:	199375
PubChem CID:	79237354
Reduced:	O3N4C12H20 (1)
Stoich.:	A3B4C12D20 (1)
Weight, g/mol:	266.093439
ΔH_f, kcal/mol:	-119.26
Dipole, Da:	3.74
IP(EA), eV:	-9.09(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-5-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNC(=O)C(CCC(=O)O)N

DOS

IR

Vibrations