Geometry & MOs

Info

ID:	364282
PubChem CID:	127315381
Reduced:	SN2O4C17H30 (1)
Stoich.:	AB2C4D17E30 (1)
Weight, g/mol:	335.220892
ΔH_f, kcal/mol:	-196.94
Dipole, Da:	3.97
IP(EA), eV:	-9.12(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CC1CCCCC1OCC(=O)N2CCN(CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations