Geometry & MOs

Info

ID:	366200
PubChem CID:	127319615
Reduced:	NSO3C16H21 (1)
Stoich.:	ABC3D16E21 (1)
Weight, g/mol:	373.146013
ΔH_f, kcal/mol:	-133.4
Dipole, Da:	3.32
IP(EA), eV:	-9.14(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-1-(4-methylphenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations