Geometry & MOs

Info

ID:	353658
PubChem CID:	127285235
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	347.200905
ΔH_f, kcal/mol:	-87.24
Dipole, Da:	4.77
IP(EA), eV:	-9.43(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-2-(2-methyl-3-oxopiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1CC(=O)NC(C2CCCCC2)C3=CC=CC=C3

DOS

IR

Vibrations