Geometry & MOs

Info

ID:	164095
PubChem CID:	74381933
Reduced:	FN2O3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	472.175813
ΔH_f, kcal/mol:	-139.47
Dipole, Da:	4.54
IP(EA), eV:	-8.95(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[4-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl]benzoyl]amino] 4-aminobutanoate

Drug info:

PubChemData

Smile

CCNC(=O)C1CC(C(C2C1C3=CC=CC=C3O2)O)NCC4=CC=C(C=C4)F

DOS

IR

Vibrations