Geometry & MOs

Info

ID:	302790
PubChem CID:	124395412
Reduced:	N4O5H22C23 (1)
Stoich.:	A4B5C22D23 (1)
Weight, g/mol:	480.133279
ΔH_f, kcal/mol:	-22.15
Dipole, Da:	11.14
IP(EA), eV:	-9.04(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[(4Z)-4-[[4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene]-2,5-dioxoimidazolidin-1-yl]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

COC1=CC2=CC=CC=C2C=C1C(=O)N/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

DOS

IR

Vibrations