Geometry & MOs

Info

ID:	325881
PubChem CID:	126685411
Reduced:	ClNF2O2C15H18 (1)
Stoich.:	ABC2D2E15F18 (1)
Weight, g/mol:	464.185983
ΔH_f, kcal/mol:	-205.69
Dipole, Da:	5.25
IP(EA), eV:	-9.71(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[(2S,3S)-2-amino-3-(4-fluorophenyl)-3-(2-propan-2-yloxypyrimidin-5-yl)propanoyl]-4-phenyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CCC1C(C2=CC=C(C=C2)Cl)[C@@H](C(=O)O)N)(F)F

DOS

IR

Vibrations