Geometry & MOs

Info

ID:	396957
PubChem CID:	135029510
Reduced:	N2O4H16C19 (1)
Stoich.:	A2B4C16D19 (1)
Weight, g/mol:	326.090272
ΔH_f, kcal/mol:	-109.22
Dipole, Da:	4.43
IP(EA), eV:	-9.59(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-(furan-2-yl)-2,4-dioxo-3-phenyl-1H-pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations