Geometry & MOs

Info

ID:	353929
PubChem CID:	127285569
Reduced:	SO3N5C16H25 (1)
Stoich.:	AB3C5D16E25 (1)
Weight, g/mol:	253.179027
ΔH_f, kcal/mol:	-95.51
Dipole, Da:	1.84
IP(EA), eV:	-8.73(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-oxo-2-propan-2-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NCCN1C(=O)NC2=NC(=CS2)CN3CCOCC3

DOS

IR

Vibrations