Geometry & MOs

Info

ID:	158989
PubChem CID:	57244375
Reduced:	S2N5O7C9H15 (1)
Stoich.:	A2B5C7D9E15 (1)
Weight, g/mol:	235.052781
ΔH_f, kcal/mol:	-256.37
Dipole, Da:	2.24
IP(EA), eV:	-9.78(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)NS(=O)(=O)NC(=O)NC1=NC(=CC(=N1)OC)OC

DOS

IR

Vibrations