Geometry & MOs

Info

ID:	418829
PubChem CID:	135106934
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	355.153206
ΔH_f, kcal/mol:	-24.57
Dipole, Da:	3.9
IP(EA), eV:	-8.87(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(8-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)pyridazine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)N1C=CC=C1C(=O)N2CC(C2)N3CCCCC3

DOS

IR

Vibrations