Geometry & MOs

Info

ID:	357555
PubChem CID:	127294218
Reduced:	S3N4O4C12H18 (1)
Stoich.:	A3B4C4D12E18 (1)
Weight, g/mol:	354.082033
ΔH_f, kcal/mol:	-132.42
Dipole, Da:	10.78
IP(EA), eV:	-8.61(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-thiomorpholin-4-ylsulfonylethyl)-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=CS1)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations