Geometry & MOs

Info

ID:	62597
PubChem CID:	26725229
Reduced:	S2N3O6C17H23 (1)
Stoich.:	A2B3C6D17E23 (1)
Weight, g/mol:	489.123957
ΔH_f, kcal/mol:	-209.78
Dipole, Da:	6.52
IP(EA), eV:	-9.53(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethoxyphenyl)sulfonyl-N'-[(3R)-1,1-dioxothiolane-3-carbonyl]piperidine-4-carbohydrazide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@H]1C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations