Geometry & MOs

Info

ID:	7302
PubChem CID:	72086
Reduced:	N4O6H10C11 (1)
Stoich.:	A4B6C10D11 (1)
Weight, g/mol:	294.060034
ΔH_f, kcal/mol:	-78.76
Dipole, Da:	4.55
IP(EA), eV:	-9.59(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(hydroxymethyl)-1-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylideneamino]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1C(=O)N(C(=O)N1/N=C/C=CC2=CC=C(O2)[N+](=O)[O-])CO

DOS

IR

Vibrations