Geometry & MOs

Info

ID:	29430
PubChem CID:	833720
Reduced:	SCl2N4H10C14 (1)
Stoich.:	AB2C4D10E14 (1)
Weight, g/mol:	269.013809
ΔH_f, kcal/mol:	115.15
Dipole, Da:	5.65
IP(EA), eV:	-9.45(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CSC2=NN=NN2C3=CC(=CC=C3)Cl)Cl

DOS

IR

Vibrations