Geometry & MOs

Info

ID:	415074
PubChem CID:	135088060
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	361.114793
ΔH_f, kcal/mol:	-63.97
Dipole, Da:	5.21
IP(EA), eV:	-9.21(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluoro-4-hydroxyphenyl)-1-spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-ylethanone

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2OC)C(=O)C3=NC4=CC=CC=C4C(=C3)OC

DOS

IR

Vibrations