Geometry & MOs

Info

ID:	63566
PubChem CID:	26758638
Reduced:	FNO5C21H22 (1)
Stoich.:	ABC5D21E22 (1)
Weight, g/mol:	375.128214
ΔH_f, kcal/mol:	-215.32
Dipole, Da:	6.32
IP(EA), eV:	-9.05(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 4-(4-fluorophenyl)-4-oxobutanoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCC1=CC=CC=C1OC)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations