Geometry & MOs

Info

ID:	288753
PubChem CID:	104325015
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	297.08235
ΔH_f, kcal/mol:	-62.87
Dipole, Da:	0.86
IP(EA), eV:	-8.38(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-phenylethoxy)-1-benzofuran-2-carbothioamide

Drug info:

PubChemData

Smile

CN(C)C(=O)CCOC1=C(OC2=CC=CC=C21)C(=S)N

DOS

IR

Vibrations