Geometry & MOs

Info

ID:	60925
PubChem CID:	26703236
Reduced:	F2O2S2N5H15C18 (1)
Stoich.:	A2B2C2D5E15F18 (1)
Weight, g/mol:	381.157623
ΔH_f, kcal/mol:	-73.35
Dipole, Da:	3.43
IP(EA), eV:	-8.96(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-ethyl-1-benzofuran-3-yl)-N-(3,4,5-trimethoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)CN3C4=CC=CC=C4N=C3SC(F)F)C

DOS

IR

Vibrations