Geometry & MOs

Info

ID:	352512
PubChem CID:	127283600
Reduced:	SO2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	307.146681
ΔH_f, kcal/mol:	-3.71
Dipole, Da:	0.32
IP(EA), eV:	-9.28(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(4-methylidenepiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)CCC2=NN=C(O2)C3=CSC=C3

DOS

IR

Vibrations