Geometry & MOs

Info

ID:	351953
PubChem CID:	127282871
Reduced:	FON2C10H14 (2)
Stoich.:	ABC2D10E14 (2)
Weight, g/mol:	378.208947
ΔH_f, kcal/mol:	-179.35
Dipole, Da:	5.32
IP(EA), eV:	-9.32(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N-(2-thiophen-3-ylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)NCC3=CC(=CC(=C3)F)F

DOS

IR

Vibrations