Geometry & MOs

Info

ID:	217705
PubChem CID:	85088245
Reduced:	O3N5C21H23 (1)
Stoich.:	A3B5C21D23 (1)
Weight, g/mol:	391.201968
ΔH_f, kcal/mol:	-10.87
Dipole, Da:	3.66
IP(EA), eV:	-8.91(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(3-fluoro-4-piperazin-1-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C1N=CN=C2N1NCC2C(C3=CC=C(C=C3)C(=O)OC)O)C4=CC=CC=C4

DOS

IR

Vibrations