Geometry & MOs

Info

ID:	130125
PubChem CID:	51074986
Reduced:	ON4C20H20 (1)
Stoich.:	AB4C20D20 (1)
Weight, g/mol:	301.088498
ΔH_f, kcal/mol:	52.63
Dipole, Da:	7.05
IP(EA), eV:	-9.54(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(1-methylidene-3-oxoisoindol-2-yl)propanamide

Drug info:

PubChemData

Smile

C1CC2=NN=C(N2C1)CCNC(=O)C3=CC=CC=C3C4=CC=CC=C4

DOS

IR

Vibrations