Geometry & MOs

Info

ID:	354835
PubChem CID:	127287595
Reduced:	FSN3O3C18H26 (1)
Stoich.:	ABC3D3E18F26 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	-158.13
Dipole, Da:	3.56
IP(EA), eV:	-8.66(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-[3-(morpholin-4-ylmethyl)phenyl]methanone

Drug info:

PubChemData

Smile

CN1CCC(C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations