Geometry & MOs

Info

ID:	26719
PubChem CID:	794756
Reduced:	OH4C5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	348.08341
ΔH_f, kcal/mol:	-78.16
Dipole, Da:	3.76
IP(EA), eV:	-8.87(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(hydroxyiminomethyl)-2-[3-(trifluoromethyl)anilino]pyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2

DOS

IR

Vibrations