Geometry & MOs

Info

ID:	131352
PubChem CID:	51194416
Reduced:	SN4O5C15H16 (1)
Stoich.:	AB4C5D15E16 (1)
Weight, g/mol:	339.071134
ΔH_f, kcal/mol:	-68.17
Dipole, Da:	6.28
IP(EA), eV:	-9.75(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-5-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3CCS(=O)(=O)C3

DOS

IR

Vibrations