Geometry & MOs

Info

ID:	351780
PubChem CID:	127282180
Reduced:	O4N5C18H29 (1)
Stoich.:	A4B5C18D29 (1)
Weight, g/mol:	333.216475
ΔH_f, kcal/mol:	-181.14
Dipole, Da:	5.9
IP(EA), eV:	-8.96(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(1-methylpyrazole-4-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)CN3C(=O)CN(C3=O)C

DOS

IR

Vibrations