Geometry & MOs

Info

ID:	130144
PubChem CID:	51075049
Reduced:	O2N5C14H17 (1)
Stoich.:	A2B5C14D17 (1)
Weight, g/mol:	341.119798
ΔH_f, kcal/mol:	-3.45
Dipole, Da:	4.3
IP(EA), eV:	-8.63(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CC(=N1)NC(=O)C2=CN=C(C=C2)N3CCOCC3

DOS

IR

Vibrations