Geometry & MOs

Info

ID:	63732
PubChem CID:	26759060
Reduced:	FNO5C19H20 (1)
Stoich.:	ABC5D19E20 (1)
Weight, g/mol:	361.132551
ΔH_f, kcal/mol:	-208.59
Dipole, Da:	9.23
IP(EA), eV:	-8.94(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations