Geometry & MOs

Info

ID:	360742
PubChem CID:	127301387
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	274.098728
ΔH_f, kcal/mol:	-46.58
Dipole, Da:	3.94
IP(EA), eV:	-9.46(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]morpholine

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)N2CCC3=CC=CC=C3C2

DOS

IR

Vibrations