Geometry & MOs

Info

ID:	436435
PubChem CID:	135202766
Reduced:	Cl2N2F3O4H7C13 (1)
Stoich.:	A2B2C3D4E7F13 (1)
Weight, g/mol:	209.080041
ΔH_f, kcal/mol:	-291.64
Dipole, Da:	5.86
IP(EA), eV:	-10.22(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-hydroxy-1,2-dihydroimidazo[1,5-a]pyrimidine-8-carboxylate

Drug info:

PubChemData

Smile

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl)C(F)(F)F

DOS

IR

Vibrations