Geometry & MOs

Info

ID:	351795
PubChem CID:	127282195
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	385.182398
ΔH_f, kcal/mol:	-146.07
Dipole, Da:	3.41
IP(EA), eV:	-8.9(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-cyclopentylpropanamide

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCC(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations