Geometry & MOs

Info

ID:	27835
PubChem CID:	823805
Reduced:	ClOSN3C11H14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	276.127406
ΔH_f, kcal/mol:	-27.74
Dipole, Da:	3.77
IP(EA), eV:	-9.07(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorophenyl)-1-oxa-3,4-diazaspiro[4.5]dec-2-en-4-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC(=S)NC1=NC=C(C=C1)Cl

DOS

IR

Vibrations