Geometry & MOs

Info

ID:	190737
PubChem CID:	78050229
Reduced:	N2O6C25H28 (1)
Stoich.:	A2B6C25D28 (1)
Weight, g/mol:	315.104148
ΔH_f, kcal/mol:	-213.83
Dipole, Da:	7.37
IP(EA), eV:	-8.65(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-2-(morpholin-4-ylmethyl)-9bH-[1,3]thiazolo[5,4-c]isoquinolin-5-one

Drug info:

PubChemData

Smile

CC1C(CN(C1=O)CC2=C(C=C(C=C2)OC)OC)C(=O)N3C(COC3=O)CC4=CC=CC=C4

DOS

IR

Vibrations