Geometry & MOs

Info

ID:	222753
PubChem CID:	85332387
Reduced:	BN4O5C28H35 (1)
Stoich.:	AB4C5D28E35 (1)
Weight, g/mol:	518.212947
ΔH_f, kcal/mol:	-241.1
Dipole, Da:	3.16
IP(EA), eV:	-9.02(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-difluorophenyl)-2-oxo-N-(3-spiro[indeno[2,1-b]pyridine-9,4'-piperidine]-1'-ylpropyl)-1,3-oxazolidine-3-carboxamide

Drug info:

PubChemData

Smile

B1(OC2C3CC(C3(C)C)CC2(O1)C)C(CC)NC(=O)C4CCC5=NC=C(C(=O)N45)NC(=O)C6=CC=CC=C6

DOS

IR

Vibrations