Geometry & MOs

Info

ID:	289727
PubChem CID:	104370507
Reduced:	ClN2O2F3H10C13 (1)
Stoich.:	AB2C2D3E10F13 (1)
Weight, g/mol:	216.066555
ΔH_f, kcal/mol:	-197.77
Dipole, Da:	4.82
IP(EA), eV:	-10.11(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-6-chloro-5-methyl-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations