Geometry & MOs

Info

ID:	310485
PubChem CID:	126580747
Reduced:	OF2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	207.173548
ΔH_f, kcal/mol:	-136.57
Dipole, Da:	4.12
IP(EA), eV:	-9.17(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(azetidin-3-yl)ethyl]-4-methylpiperidine-4-carbonitrile

Drug info:

PubChemData

Smile

C1CN(C(=O)CN1CC(F)F)CCC2CNC2

DOS

IR

Vibrations