Geometry & MOs

Info

ID:	299920
PubChem CID:	117931954
Reduced:	FOC9H15 (2)
Stoich.:	ABC9D15 (2)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	-256.74
Dipole, Da:	2.59
IP(EA), eV:	-9.85(1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylpropyl)-4-(6-methoxypyridin-2-yl)piperidine-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C)(C)C(CCOCC12CC3CC(C1)C(C(C3)C2)O)(F)F

DOS

IR

Vibrations