Geometry & MOs

Info

ID:	34152
PubChem CID:	7890074
Reduced:	FNO6H16C20 (1)
Stoich.:	ABC6D16E20 (1)
Weight, g/mol:	336.11215
ΔH_f, kcal/mol:	-244.54
Dipole, Da:	6.76
IP(EA), eV:	-9.35(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4R)-6-[(4-fluorobenzoyl)oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations