Geometry & MOs

Info

ID:	56544
PubChem CID:	17436217
Reduced:	SO2N5C17H25 (1)
Stoich.:	AB2C5D17E25 (1)
Weight, g/mol:	282.082684
ΔH_f, kcal/mol:	-41.02
Dipole, Da:	2.73
IP(EA), eV:	-8.73(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(4,5-dihydro-1,3-thiazol-2-yl)-3-naphthalen-1-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=NC(=C12)N(C)CC(=O)NC)CN3CCOCC3)C

DOS

IR

Vibrations