Geometry & MOs

Info

ID:	351497
PubChem CID:	127280385
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-156.56
Dipole, Da:	4.02
IP(EA), eV:	-9.02(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(1,3-dihydro-2-benzofuran-5-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCN(CC1)C(=O)CN2CCCC2)N3CCCC3=O

DOS

IR

Vibrations