Geometry & MOs

Info

ID:	417939
PubChem CID:	135103113
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	14.19
Dipole, Da:	4.78
IP(EA), eV:	-8.79(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,7-dimethoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-N,N-dimethylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)CC4=CC5=CC=CC=C5N(C4=O)C

DOS

IR

Vibrations