Geometry & MOs

Info

ID:	422984
PubChem CID:	135118728
Reduced:	ON7C14H17 (1)
Stoich.:	AB7C14D17 (1)
Weight, g/mol:	286.113984
ΔH_f, kcal/mol:	49.59
Dipole, Da:	6.19
IP(EA), eV:	-9.02(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-pyridin-4-ylspiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C[C@@H]2CN(C[C@@H]2O)C3=NC=C(C(=N3)N)C#N

DOS

IR

Vibrations