Geometry & MOs

Info

ID:	364774
PubChem CID:	127316112
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-42.33
Dipole, Da:	5.27
IP(EA), eV:	-9.09(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[2-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2(CCOCC2)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations