Geometry & MOs

Info

ID:	76646
PubChem CID:	48425189
Reduced:	SF3N3O3C15H24 (1)
Stoich.:	AB3C3D3E15F24 (1)
Weight, g/mol:	380.203525
ΔH_f, kcal/mol:	-299.99
Dipole, Da:	2.33
IP(EA), eV:	-8.63(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazine-1-carbonyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOCC(F)(F)F)C(=O)CCN2CCSC2=O

DOS

IR

Vibrations