Geometry & MOs

Info

ID:	419831
PubChem CID:	135109226
Reduced:	NO2S2C19H23 (1)
Stoich.:	AB2C2D19E23 (1)
Weight, g/mol:	304.124549
ΔH_f, kcal/mol:	-51.86
Dipole, Da:	4.32
IP(EA), eV:	-8.93(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dihydro-1H-pyrrol-2-yl(spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)CCCC3=CC=CS3)C4=C1SC=C4

DOS

IR

Vibrations