Geometry & MOs

Info

ID:	274285
PubChem CID:	103808302
Reduced:	N2O2F3C14H17 (1)
Stoich.:	A2B2C3D14E17 (1)
Weight, g/mol:	286.154209
ΔH_f, kcal/mol:	-233.83
Dipole, Da:	3.11
IP(EA), eV:	-9.46(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[3-(1-methyltetrazol-5-yl)phenyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)NCC2=CC=C(C=C2)OC(F)(F)F

DOS

IR

Vibrations