Geometry & MOs

Info

ID:	63547
PubChem CID:	26758594
Reduced:	FNO5C22H24 (1)
Stoich.:	ABC5D22E24 (1)
Weight, g/mol:	378.078263
ΔH_f, kcal/mol:	-219.99
Dipole, Da:	6.5
IP(EA), eV:	-8.89(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] 4-(4-fluorophenyl)-4-oxobutanoate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCCC1=CC=C(C=C1)OC)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations