Geometry & MOs

Info

ID:	216465
PubChem CID:	85086277
Reduced:	NSO2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	271.178358
ΔH_f, kcal/mol:	129.79
Dipole, Da:	4.15
IP(EA), eV:	-9.15(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxy-2-propan-2-ylpentanoyl)-4-propan-2-yl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1CN(CC#CC=CC#C1)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations