Geometry & MOs

Info

ID:	351936
PubChem CID:	127282854
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	398.154325
ΔH_f, kcal/mol:	-130.59
Dipole, Da:	4.25
IP(EA), eV:	-8.91(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]-4-[1-(cyclopentylamino)-1-oxopropan-2-yl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(CC2)NC(=O)N3CCC(CC3)C(=O)N4CCOCC4

DOS

IR

Vibrations