Geometry & MOs

Info

ID:	141917
PubChem CID:	52952197
Reduced:	NO3C23H23 (1)
Stoich.:	AB3C23D23 (1)
Weight, g/mol:	371.08848
ΔH_f, kcal/mol:	-53.69
Dipole, Da:	6.34
IP(EA), eV:	-8.92(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-benzyl-6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]

Drug info:

PubChemData

Smile

C1CN(CCC12C=CC3=C(O2)C=CC(=C3)/C=C/C(=O)O)CC4=CC=CC=C4

DOS

IR

Vibrations