Geometry & MOs

Info

ID:	415968
PubChem CID:	135088973
Reduced:	O2N3C22H23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	374.220557
ΔH_f, kcal/mol:	3.75
Dipole, Da:	5.09
IP(EA), eV:	-9.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6,7-dimethoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-[(2S)-piperidin-2-yl]methanone

Drug info:

PubChemData

Smile

C1CC1N2C=CC=C2C(=O)N3C[C@H]([C@@H](C3)O)CC4=NC5=CC=CC=C5C=C4

DOS

IR

Vibrations