Geometry & MOs

Info

ID:	425159
PubChem CID:	135125374
Reduced:	N2O3C24H24 (1)
Stoich.:	A2B3C24D24 (1)
Weight, g/mol:	388.178693
ΔH_f, kcal/mol:	-81.42
Dipole, Da:	5.62
IP(EA), eV:	-8.8(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-methylisoquinolin-6-yl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC2=C1N=CC=C2)C3=CC4=C(C=C3)OC5(CC4)CCN(CC5)C(=O)O

DOS

IR

Vibrations