Geometry & MOs

Info

ID:	419400
PubChem CID:	135108119
Reduced:	FN2O5C16H17 (1)
Stoich.:	AB2C5D16E17 (1)
Weight, g/mol:	380.155849
ΔH_f, kcal/mol:	-174.49
Dipole, Da:	5.06
IP(EA), eV:	-9.38(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(8-methoxy-4-methylquinolin-2-yl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=C(C(=NO2)NC[C@@H]3CCCO3)C(=O)O)F

DOS

IR

Vibrations