Geometry & MOs

Info

ID:	393082
PubChem CID:	135019307
Reduced:	SN2O3H30C32 (1)
Stoich.:	AB2C3D30E32 (1)
Weight, g/mol:	382.15037
ΔH_f, kcal/mol:	24.0
Dipole, Da:	5.8
IP(EA), eV:	-8.71(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-N-benzyl-1-benzylidene-6,10b-dihydro-5H-[1,3]thiazolo[4,3-a]isoquinolin-3-imine

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)C2/C(=C/C3=CC=CC=C3)/SC(=NC4=CC=CC=C4)N2CC5=CC=CC=C5

DOS

IR

Vibrations