Geometry & MOs

Info

ID:	414901
PubChem CID:	135087873
Reduced:	SO2N4C20H22 (1)
Stoich.:	AB2C4D20E22 (1)
Weight, g/mol:	393.151098
ΔH_f, kcal/mol:	-6.2
Dipole, Da:	4.5
IP(EA), eV:	-9.26(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-2-phenyl-1H-imidazol-4-yl)-spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCSC2=C(C=CC=N2)C(=O)N(CCO)CC3=NC=CN3

DOS

IR

Vibrations