Geometry & MOs

Info

ID:	184265
PubChem CID:	77137428
Reduced:	N2O4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	449.12661
ΔH_f, kcal/mol:	-95.81
Dipole, Da:	5.68
IP(EA), eV:	-9.46(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[4-[1-[(5-chlorofuran-2-yl)methyl]-5,6-dihydro-1,2,4-triazin-4-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CC3CC(C2)N3.C1=CC=C(C=C1)C(C(=O)O)O

DOS

IR

Vibrations