Geometry & MOs

Info

ID:	59411
PubChem CID:	24856764
Reduced:	ON8C22H26 (1)
Stoich.:	AB8C22D26 (1)
Weight, g/mol:	445.201299
ΔH_f, kcal/mol:	81.53
Dipole, Da:	3.08
IP(EA), eV:	-8.52(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-fluoro-4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidin-3-yl] 2-oxa-4-azatricyclo[3.3.1.13,7]decane-4-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC2=NC=C(N3C2=NC=C3)C4=CNN=C4

DOS

IR

Vibrations