Geometry & MOs

Info

ID:	414423
PubChem CID:	135087381
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	340.178693
ΔH_f, kcal/mol:	-105.13
Dipole, Da:	3.31
IP(EA), eV:	-9.53(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-1'-pyridin-4-ylspiro[3,4-dihydroisochromene-1,4'-piperidine]

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1C[C@H]([C@@H](C1)O)CC2=NC=CN=C2)OC

DOS

IR

Vibrations