Geometry & MOs

Info

ID:	121015
PubChem CID:	50753365
Reduced:	SN3O4H15C16 (1)
Stoich.:	AB3C4D15E16 (1)
Weight, g/mol:	367.102434
ΔH_f, kcal/mol:	-77.56
Dipole, Da:	8.52
IP(EA), eV:	-9.86(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxothiolan-3-yl)-N-(2-methylpropyl)-5-thiophen-2-ylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)OC(=O)CSC2=NC(=O)C(=C(N2)C3=CC=CO3)C#N

DOS

IR

Vibrations