Geometry & MOs

Info

ID:	363486
PubChem CID:	127311289
Reduced:	FO2N4C21H27 (1)
Stoich.:	AB2C4D21E27 (1)
Weight, g/mol:	349.21139
ΔH_f, kcal/mol:	-65.0
Dipole, Da:	4.29
IP(EA), eV:	-8.77(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-1-oxopropan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CN2CCN(CC2)C(=O)C3(CCCCC3)C4=CC(=CC=C4)F

DOS

IR

Vibrations