Geometry & MOs

Info

ID:	366195
PubChem CID:	127319610
Reduced:	SN3O4C19H19 (1)
Stoich.:	AB3C4D19E19 (1)
Weight, g/mol:	321.089561
ΔH_f, kcal/mol:	-68.3
Dipole, Da:	7.59
IP(EA), eV:	-9.44(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4CCCS(=O)(=O)C4

DOS

IR

Vibrations