Geometry & MOs

Info

ID:	355584
PubChem CID:	127289342
Reduced:	ON6C18H22 (1)
Stoich.:	AB6C18D22 (1)
Weight, g/mol:	347.232125
ΔH_f, kcal/mol:	43.04
Dipole, Da:	4.05
IP(EA), eV:	-8.89(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)N3CCN(CC3)CC4=NC=CN4C)NN=C2

DOS

IR

Vibrations