Geometry & MOs

Info

ID:	363860
PubChem CID:	127313517
Reduced:	FN3O3C21H26 (1)
Stoich.:	AB3C3D21E26 (1)
Weight, g/mol:	389.150619
ΔH_f, kcal/mol:	-127.81
Dipole, Da:	2.44
IP(EA), eV:	-8.94(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=C(C=C2)F)C(=O)NCCN3CCN(CC3)C(=O)C4CCC4

DOS

IR

Vibrations