Geometry & MOs

Info

ID:	416654
PubChem CID:	135089961
Reduced:	ClSN3O4C17H22 (1)
Stoich.:	ABC3D4E17F22 (1)
Weight, g/mol:	445.201299
ΔH_f, kcal/mol:	-136.42
Dipole, Da:	5.97
IP(EA), eV:	-8.92(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluoro-3-methoxyphenyl)-3-(3-oxo-2-propan-2-yl-2,8-diazaspiro[5.5]undecan-8-yl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1C(=CC2=C1C=C(C=C2)Cl)C(=O)N[C@@H]3COC[C@H]3CS(=O)(=O)N(C)C

DOS

IR

Vibrations