Geometry & MOs

Info

ID:	63544
PubChem CID:	26758585
Reduced:	FNO4C22H24 (1)
Stoich.:	ABC4D22E24 (1)
Weight, g/mol:	401.163851
ΔH_f, kcal/mol:	-188.14
Dipole, Da:	5.85
IP(EA), eV:	-8.83(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC=CC=C1C(C)C)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations