Geometry & MOs

Info

ID:	348494
PubChem CID:	127273605
Reduced:	OSN5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	360.01176
ΔH_f, kcal/mol:	17.35
Dipole, Da:	3.77
IP(EA), eV:	-8.4(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[2-(6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-2-oxoethyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)N1C=CN=C1SCC(=O)N2CCCN3C2=CC=N3

DOS

IR

Vibrations