Geometry & MOs

Info

ID:	171411
PubChem CID:	75374979
Reduced:	OSN5C15H25 (1)
Stoich.:	ABC5D15E25 (1)
Weight, g/mol:	307.139528
ΔH_f, kcal/mol:	-1.01
Dipole, Da:	3.97
IP(EA), eV:	-9.06(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl 3,4-dihydro-2H-pyran-5-carboxylate

Drug info:

PubChemData

Smile

CC1=NSC(=N1)N2CCCN(CC2)CC(=O)NC(C)C3CC3

DOS

IR

Vibrations