Geometry & MOs

Info

ID:	365878
PubChem CID:	127319128
Reduced:	OSN5C20H25 (1)
Stoich.:	ABC5D20E25 (1)
Weight, g/mol:	383.177982
ΔH_f, kcal/mol:	13.49
Dipole, Da:	8.1
IP(EA), eV:	-8.43(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyl-N-(2-pyridin-2-ylsulfanylpyridin-4-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2CCCN(C2)C(=O)NC3=CC(=NC=C3)SC4=CC=CC=N4

DOS

IR

Vibrations