Geometry & MOs

Info

ID:	184598
PubChem CID:	77182487
Reduced:	N2O5C17H18 (1)
Stoich.:	A2B5C17D18 (1)
Weight, g/mol:	522.211449
ΔH_f, kcal/mol:	-117.83
Dipole, Da:	2.88
IP(EA), eV:	-8.21(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-cyclohexa-1,3-dien-1-yl-1,4-dioxin-2-yl)-5-[1-hydroxy-2-[[2-hydroxy-2-(3-methoxyquinoxalin-5-yl)ethyl]-methylamino]ethyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C=CC(=O)NCC1CN(C(=O)O1)C2=COC=C(O2)C3=CC=CCC3

DOS

IR

Vibrations