Geometry & MOs

Info

ID:	189536
PubChem CID:	77868929
Reduced:	O7C23H32 (1)
Stoich.:	A7B23C32 (1)
Weight, g/mol:	378.149204
ΔH_f, kcal/mol:	-232.78
Dipole, Da:	8.01
IP(EA), eV:	-8.6(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-[2-fluoro-4-(5-methyl-2-oxo-1,3-oxazolidin-3-yl)phenyl]pyridin-2-yl]-3-azabicyclo[3.1.0]hexane-6-carbonitrile

Drug info:

PubChemData

Smile

CC1CC=CC(C(CCC=CC2=C(C(=CC(=C2)OC)OC)C(=O)O1)OC(C)(C)O)O

DOS

IR

Vibrations