Geometry & MOs

Info

ID:	230316
PubChem CID:	87570636
Reduced:	NO5C22H33 (1)
Stoich.:	AB5C22D33 (1)
Weight, g/mol:	222.097998
ΔH_f, kcal/mol:	-194.31
Dipole, Da:	5.1
IP(EA), eV:	-8.97(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-azabicyclo[3.2.1]octan-1-yl)-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)C(=NOCCCCC2COC(OC2)(C)C(=O)O)C

DOS

IR

Vibrations