Geometry & MOs

Info

ID:	306224
PubChem CID:	125002939
Reduced:	FN3O4C19H20 (1)
Stoich.:	AB3C4D19E20 (1)
Weight, g/mol:	426.251858
ΔH_f, kcal/mol:	-174.08
Dipole, Da:	10.36
IP(EA), eV:	-9.35(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S,9E)-1'-[2-(oxan-4-yl)acetyl]spiro[2-oxa-5-azabicyclo[10.4.0]hexadeca-1(16),9,12,14-tetraene-7,3'-piperidine]-4-one

Drug info:

PubChemData

Smile

C[C@@]1(CN(CCO1)C(=O)C2=CC=CN(C2=O)CC3=CC=CC=C3F)C(=O)N

DOS

IR

Vibrations