Geometry & MOs

Info

ID:	335702
PubChem CID:	127254564
Reduced:	SN4O5C13H20 (1)
Stoich.:	AB4C5D13E20 (1)
Weight, g/mol:	378.14741
ΔH_f, kcal/mol:	-157.88
Dipole, Da:	8.21
IP(EA), eV:	-8.65(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-methyl-2-(tetrazol-1-yl)pentanamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=O)C(=CN2)OC

DOS

IR

Vibrations