Geometry & MOs

Info

ID:	149340
PubChem CID:	53789012
Reduced:	NO6H9C10 (1)
Stoich.:	AB6C9D10 (1)
Weight, g/mol:	221.041211
ΔH_f, kcal/mol:	-232.44
Dipole, Da:	5.52
IP(EA), eV:	-10.81(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-5-(trifluoromethyl)-1H-pyrimidin-6-yl]acetamide

Drug info:

PubChemData

Smile

C1C2C(C(C3C1C(=O)OC3=O)N)C(=O)OC2=O

DOS

IR

Vibrations