Geometry & MOs

Info

ID:	415781
PubChem CID:	135088782
Reduced:	FSN3O3C15H22 (1)
Stoich.:	ABC3D3E15F22 (1)
Weight, g/mol:	394.135114
ΔH_f, kcal/mol:	-155.09
Dipole, Da:	3.45
IP(EA), eV:	-8.82(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-3-phenyl-1,2-oxazol-4-yl)-spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)S(=O)(=O)NCC(=O)NCC2CCN(C2)C)F

DOS

IR

Vibrations