Geometry & MOs

Info

ID:	321048
PubChem CID:	126664553
Reduced:	SN3O6C28H41 (1)
Stoich.:	AB3C6D28E41 (1)
Weight, g/mol:	490.176481
ΔH_f, kcal/mol:	-265.53
Dipole, Da:	2.74
IP(EA), eV:	-9.54(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(N2CC1CCCS2(=O)=O)/C=C/[C@H]3CCCC[C@@H]3NC(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations