Geometry & MOs

Info

ID:	285362
PubChem CID:	104102602
Reduced:	ClSN2O5C11H13 (1)
Stoich.:	ABC2D5E11F13 (1)
Weight, g/mol:	158.105528
ΔH_f, kcal/mol:	-94.68
Dipole, Da:	6.36
IP(EA), eV:	-9.85(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-methyl-1-(1,2-oxazolidin-2-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1S(=O)(=O)N2CCCCO2)[N+](=O)[O-])Cl

DOS

IR

Vibrations