Geometry & MOs

Info

ID:	419130
PubChem CID:	135107567
Reduced:	O2N6C19H20 (1)
Stoich.:	A2B6C19D20 (1)
Weight, g/mol:	376.182064
ΔH_f, kcal/mol:	26.82
Dipole, Da:	1.92
IP(EA), eV:	-9.41(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropyl)-4-(spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-carbonyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C[C@@H]2CN(C[C@@H]2O)C(=O)C3=CN=C(N=C3)C4=CC=CC=N4

DOS

IR

Vibrations