Geometry & MOs

Info

ID:	353594
PubChem CID:	127285171
Reduced:	S2N3O4C15H21 (1)
Stoich.:	A2B3C4D15E21 (1)
Weight, g/mol:	346.121195
ΔH_f, kcal/mol:	-138.44
Dipole, Da:	8.1
IP(EA), eV:	-9.54(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(tetrazol-1-yl)thiophene-2-carbonyl]piperidin-4-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2CCN(CC2)C(=O)CNS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations