Geometry & MOs

Info

ID:	130410
PubChem CID:	51075853
Reduced:	SO2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	331.099063
ΔH_f, kcal/mol:	-41.88
Dipole, Da:	5.94
IP(EA), eV:	-9.04(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-3-[5-(2-methylcyclopropyl)furan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(C)NC(=O)C2=C(SN=C2C)NC

DOS

IR

Vibrations