Geometry & MOs

Info

ID:	157901
PubChem CID:	56458866
Reduced:	SN3O4H23C25 (1)
Stoich.:	AB3C4D23E25 (1)
Weight, g/mol:	448.135131
ΔH_f, kcal/mol:	-83.09
Dipole, Da:	7.32
IP(EA), eV:	-8.26(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(1-cyclopentyltetrazol-5-yl)sulfanylacetyl]-N-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)C2CSCN2C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations