Geometry & MOs

Info

ID:	285346
PubChem CID:	104100667
Reduced:	NSO2C6H10 (2)
Stoich.:	ABC2D6E10 (2)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-158.23
Dipole, Da:	7.93
IP(EA), eV:	-9.43(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-aminophenoxy)-1-(1,2-oxazolidin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(CCC(=O)NCCC1=CC=C(S1)S(=O)(=O)N)OC

DOS

IR

Vibrations