Geometry & MOs

Info

ID:	272278
PubChem CID:	103737507
Reduced:	NO2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	297.11765
ΔH_f, kcal/mol:	-158.15
Dipole, Da:	9.47
IP(EA), eV:	-9.24(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-1-(2,4-difluoro-5-methylbenzoyl)piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=CN1)C(=O)N2CCCC[C@@H]2C(=O)OC

DOS

IR

Vibrations