Geometry & MOs

Info

ID:	59922
PubChem CID:	24902481
Reduced:	N2F3O3C16H21 (1)
Stoich.:	A2B3C3D16E21 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-291.42
Dipole, Da:	4.48
IP(EA), eV:	-9.6(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-pyrimidin-2-yloxypiperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1)OC2=NC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations