Geometry & MOs

Info

ID:	398573
PubChem CID:	135033966
Reduced:	NO2C17H29 (1)
Stoich.:	AB2C17D29 (1)
Weight, g/mol:	426.124943
ΔH_f, kcal/mol:	-120.72
Dipole, Da:	2.87
IP(EA), eV:	-8.97(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-3-[(1R)-3-(4-methylphenyl)sulfonyl-5-oxo-3-azabicyclo[4.1.0]heptan-6-yl]-4-phenyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC1CC2CC(=O)C(C3(C1)C2CCCN3)CCCOC

DOS

IR

Vibrations