Geometry & MOs

Info

ID:	351776
PubChem CID:	127282176
Reduced:	SO2N5C17H27 (1)
Stoich.:	AB2C5D17E27 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-56.73
Dipole, Da:	5.38
IP(EA), eV:	-9.28(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(3-methyl-1-benzofuran-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CCC1=C(SN=N1)C(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations