Geometry & MOs

Info

ID:	288761
PubChem CID:	104325205
Reduced:	N3O3H13C15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	283.040006
ΔH_f, kcal/mol:	8.57
Dipole, Da:	6.51
IP(EA), eV:	-9.55(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(chloromethyl)phenoxy]-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=NN(C(=C1CO)OC2=C(OC3=CC=CC=C32)C#N)C

DOS

IR

Vibrations