Geometry & MOs

Info

ID:	130820
PubChem CID:	51114533
Reduced:	ON4C25H30 (1)
Stoich.:	AB4C25D30 (1)
Weight, g/mol:	343.262363
ΔH_f, kcal/mol:	19.24
Dipole, Da:	6.64
IP(EA), eV:	-7.94(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations