Geometry & MOs

Info

ID:	351760
PubChem CID:	127282160
Reduced:	O3N4C22H30 (1)
Stoich.:	A3B4C22D30 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-133.67
Dipole, Da:	4.24
IP(EA), eV:	-8.96(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(2-pyrazol-1-ylacetyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)NC(=O)CC4

DOS

IR

Vibrations