Geometry & MOs

Info

ID:	351851
PubChem CID:	127282769
Reduced:	SO3N5C18H31 (1)
Stoich.:	AB3C5D18E31 (1)
Weight, g/mol:	299.064986
ΔH_f, kcal/mol:	-125.98
Dipole, Da:	7.37
IP(EA), eV:	-8.75(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dihydro-2-benzofuran-5-ylsulfonyl)-2-methylthiomorpholine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations