Geometry & MOs

Info

ID:	347703
PubChem CID:	127272583
Reduced:	SN3O3C16H29 (1)
Stoich.:	AB3C3D16E29 (1)
Weight, g/mol:	320.221226
ΔH_f, kcal/mol:	-145.72
Dipole, Da:	7.81
IP(EA), eV:	-9.09(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]-2-(4-methylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1CCN(CC1)CC(=O)N2CCN(CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations