Geometry & MOs

Info

ID:	425144
PubChem CID:	135125312
Reduced:	NO2C13H13 (2)
Stoich.:	AB2C13D13 (2)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-108.06
Dipole, Da:	2.97
IP(EA), eV:	-8.93(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-benzofuran-5-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)C(=O)N2CCC3(CC2)OCC4=C(O3)C=CC(=C4)C5=CC6=CC=CC=C6N=C5

DOS

IR

Vibrations