Geometry & MOs

Info

ID:	344808
PubChem CID:	127268446
Reduced:	N2S2O6C15H28 (1)
Stoich.:	A2B2C6D15E28 (1)
Weight, g/mol:	369.081698
ΔH_f, kcal/mol:	-271.99
Dipole, Da:	4.83
IP(EA), eV:	-9.46(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dioxo-N-[(1-phenylpyrazol-4-yl)methyl]thiane-4-sulfonamide

Drug info:

PubChemData

Smile

CC1CN(CCN1S(=O)(=O)CC2CCCO2)S(=O)(=O)CC3CCCO3

DOS

IR

Vibrations