Geometry & MOs

Info

ID:	289083
PubChem CID:	104334680
Reduced:	F3N3C13H18 (1)
Stoich.:	A3B3C13D18 (1)
Weight, g/mol:	182.178299
ΔH_f, kcal/mol:	-147.51
Dipole, Da:	7.02
IP(EA), eV:	-9.0(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-4-[(3-methylazetidin-1-yl)methyl]piperidine

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNC2=NC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations