Geometry & MOs

Info

ID:	145404
PubChem CID:	53517474
Reduced:	FN2O3H15C18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	317.06234
ΔH_f, kcal/mol:	-110.5
Dipole, Da:	2.71
IP(EA), eV:	-8.55(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-methyl-2,4-dioxo-7-(trifluoromethyl)pyrido[2,3-d]pyrimidin-3-yl]acetate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CC(=O)OC(C3=CC=C(C=C3)F)C(=O)N

DOS

IR

Vibrations