Geometry & MOs

Info

ID:	348397
PubChem CID:	127273490
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	335.257277
ΔH_f, kcal/mol:	-103.75
Dipole, Da:	7.1
IP(EA), eV:	-8.88(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-cyclopentylpiperazin-1-yl)-4-oxobutan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCN(CC2)C(=O)[C@H]3COCC(=O)N3CC4=CC=CC=C4

DOS

IR

Vibrations