Geometry & MOs

Info

ID:	49435
PubChem CID:	11533019
Reduced:	N3O3C28H49 (1)
Stoich.:	A3B3C28D49 (1)
Weight, g/mol:	475.129884
ΔH_f, kcal/mol:	-178.49
Dipole, Da:	4.98
IP(EA), eV:	-8.78(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-chloro-3-[(1R)-3-oxospiro[2-benzofuran-1,3'-pyrrolidine]-1'-carbonyl]phenyl]-N,N-dimethylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)N[C@@H](CCC)C(=O)NCCN(C)C

DOS

IR

Vibrations