Geometry & MOs

Info

ID:	366251
PubChem CID:	127319708
Reduced:	SN2O5C17H22 (1)
Stoich.:	AB2C5D17E22 (1)
Weight, g/mol:	335.105211
ΔH_f, kcal/mol:	-205.72
Dipole, Da:	4.46
IP(EA), eV:	-8.94(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CC(OC1)C(=O)NC2=CC=CC(=C2)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations