Geometry & MOs

Info

ID:	421943
PubChem CID:	135116885
Reduced:	ClFNO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	313.153875
ΔH_f, kcal/mol:	-178.8
Dipole, Da:	6.9
IP(EA), eV:	-9.69(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[imidazo[1,2-a]pyridin-3-ylmethyl(methyl)amino]ethyl]-6-methyl-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)F)C(=O)N2CC[C@@H]([C@H](C2)O)O)Cl

DOS

IR

Vibrations