Geometry & MOs

Info

ID:	282100
PubChem CID:	103916040
Reduced:	NO5C17H33 (1)
Stoich.:	AB5C17D33 (1)
Weight, g/mol:	325.186478
ΔH_f, kcal/mol:	-262.94
Dipole, Da:	2.02
IP(EA), eV:	-9.58(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-ethyl-4-(3,3,3-trifluoropropoxy)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC1(CCN(CC1)C(=O)OC(C)(C)C)OCCOCCOC

DOS

IR

Vibrations