Geometry & MOs

Info

ID:	152034
PubChem CID:	56310883
Reduced:	O3N6C24H32 (1)
Stoich.:	A3B6C24D32 (1)
Weight, g/mol:	409.247775
ΔH_f, kcal/mol:	-100.38
Dipole, Da:	7.9
IP(EA), eV:	-9.06(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopentylpyrazol-3-yl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCN(CC3)C(=O)CC4=CC=CC=C4C)C

DOS

IR

Vibrations