Geometry & MOs

Info

ID:	367735
PubChem CID:	127325699
Reduced:	SN3O3C19H29 (1)
Stoich.:	AB3C3D19E29 (1)
Weight, g/mol:	352.204531
ΔH_f, kcal/mol:	-89.3
Dipole, Da:	3.25
IP(EA), eV:	-8.64(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-methyl-N-[(1-methylpiperidin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CN1CCCC(C1)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CC3

DOS

IR

Vibrations