Geometry & MOs

Info

ID:	274030
PubChem CID:	103806592
Reduced:	ON3F4C10H17 (1)
Stoich.:	AB3C4D10E17 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	-234.56
Dipole, Da:	5.68
IP(EA), eV:	-9.1(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-piperazin-1-ylethyl)tricyclo[3.2.1.02,4]octane-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCN1CCNCC1)C(=O)C(C(F)F)(F)F

DOS

IR

Vibrations