Geometry & MOs

Info

ID:	182053
PubChem CID:	76834020
Reduced:	FNO4C29H40 (1)
Stoich.:	ABC4D29E40 (1)
Weight, g/mol:	479.267173
ΔH_f, kcal/mol:	-234.43
Dipole, Da:	4.39
IP(EA), eV:	-8.9(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-[1-[[3-[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]-2-oxo-1,3-oxazolidin-5-yl]methoxy]ethyl]phenyl]propanoate

Drug info:

PubChemData

Smile

CCC(C1=C(C=C(C(=C1)F)C)CCC(=O)O)OCC(CNC(C)(C)CC2CC3=CC=CC=C3C2)O

DOS

IR

Vibrations