Geometry & MOs

Info

ID:	318210
PubChem CID:	126649600
Reduced:	NO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	313.112564
ΔH_f, kcal/mol:	-118.18
Dipole, Da:	3.45
IP(EA), eV:	-9.69(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-ethoxycarbonylphenyl)-3,3-difluoropiperidine-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CC1C2=CC=CC(=C2)CO)C(=O)O

DOS

IR

Vibrations