Geometry & MOs

Info

ID:	129574
PubChem CID:	51073157
Reduced:	OS2N3C12H13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	204.089878
ΔH_f, kcal/mol:	28.91
Dipole, Da:	7.07
IP(EA), eV:	-9.42(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(2-cyanoethyl)-3-(furan-2-yl)-N-methylprop-2-enamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)SC=C2C(=O)NC3=NN=CS3

DOS

IR

Vibrations