Geometry & MOs

Info

ID:	366196
PubChem CID:	127319611
Reduced:	SO3N5C13H15 (1)
Stoich.:	AB3C5D13E15 (1)
Weight, g/mol:	331.077282
ΔH_f, kcal/mol:	-23.92
Dipole, Da:	8.52
IP(EA), eV:	-10.36(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-(1,1-dioxothian-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)C2=CC=CC=C2N3C=NN=N3

DOS

IR

Vibrations