Geometry & MOs

Info

ID:	416893
PubChem CID:	135090736
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-90.07
Dipole, Da:	3.79
IP(EA), eV:	-9.89(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-1'-(3-pyrazol-1-ylpropyl)spiro[3,4-dihydroisochromene-1,4'-piperidine]

Drug info:

PubChemData

Smile

CCC(CC)CC(=O)N[C@H]1COC[C@H]1CC2=CC=NC=C2

DOS

IR

Vibrations