Geometry & MOs

Info

ID:	424582
PubChem CID:	135123224
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	446.211804
ΔH_f, kcal/mol:	-8.23
Dipole, Da:	4.05
IP(EA), eV:	-8.69(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-fluoro-1-methylpiperidin-4-yl)oxy-5-(2-phenylpyrazol-3-yl)spiro[1H-indole-3,1'-cyclobutane]-2-one

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)N(C2=CC=CC=C2)N

DOS

IR

Vibrations