Geometry & MOs

Info

ID:	416541
PubChem CID:	135089592
Reduced:	F2O2N4C15H16 (1)
Stoich.:	A2B2C4D15E16 (1)
Weight, g/mol:	335.076219
ΔH_f, kcal/mol:	-118.1
Dipole, Da:	4.54
IP(EA), eV:	-9.55(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-1,3-thiazol-4-yl)-spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](CN1C(=O)C2=NNC(=C2)C(F)F)O)CC3=CC=NC=C3

DOS

IR

Vibrations