Geometry & MOs

Info

ID:	349911
PubChem CID:	127276716
Reduced:	SN4O5C12H14 (1)
Stoich.:	AB4C5D12E14 (1)
Weight, g/mol:	249.139865
ΔH_f, kcal/mol:	-167.32
Dipole, Da:	4.34
IP(EA), eV:	-9.61(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-4-(3-methylbutylsulfonyl)morpholine

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=N2)S(=O)(=O)N3CCOCC3)C(=O)NC1=O

DOS

IR

Vibrations