Geometry & MOs

Info

ID:	370361
PubChem CID:	127338224
Reduced:	ClN3O3C16H18 (1)
Stoich.:	AB3C3D16E18 (1)
Weight, g/mol:	340.142307
ΔH_f, kcal/mol:	-58.46
Dipole, Da:	3.26
IP(EA), eV:	-9.82(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]-6-azaspiro[2.5]octane-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C1=NOC(=N1)C2CCOC2)NC(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations