Geometry & MOs

Info

ID:	172279
PubChem CID:	75488469
Reduced:	NF3O3H10C14 (1)
Stoich.:	AB3C3D10E14 (1)
Weight, g/mol:	337.167794
ΔH_f, kcal/mol:	-227.78
Dipole, Da:	2.46
IP(EA), eV:	-9.86(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-[4-(piperidine-1-carbonyl)phenyl]phenyl]acetate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=NC=C1)C2=CC=C(C=C2)OC(F)(F)F

DOS

IR

Vibrations