Geometry & MOs

Info

ID:	297404
PubChem CID:	117616938
Reduced:	SN2O3H18C21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	434.166414
ΔH_f, kcal/mol:	-5.68
Dipole, Da:	1.99
IP(EA), eV:	-8.8(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-2-propan-2-ylimino-3-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1CC1N=C2N(C(=O)/C(=C/C3=CC4=C(C=C3)OCCO4)/S2)C5=CC=CC=C5

DOS

IR

Vibrations