Geometry & MOs

Info

ID:	357695
PubChem CID:	127294369
Reduced:	ClN2S2O3C16H17 (1)
Stoich.:	AB2C2D3E16F17 (1)
Weight, g/mol:	358.069085
ΔH_f, kcal/mol:	-65.55
Dipole, Da:	4.67
IP(EA), eV:	-9.36(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxolan-2-yl)-N-(2-thiomorpholin-4-ylsulfonylethyl)methanesulfonamide

Drug info:

PubChemData

Smile

C1CC2C(C1)OCCN2S(=O)(=O)C3=CSC(=N3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations