Geometry & MOs

Info

ID:	372447
PubChem CID:	131297809
Reduced:	ON5C9H9 (1)
Stoich.:	AB5C9D9 (1)
Weight, g/mol:	203.058243
ΔH_f, kcal/mol:	78.0
Dipole, Da:	4.65
IP(EA), eV:	-9.84(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-7-methoxy-3-methyl-1-benzofuran-5-carbonitrile

Drug info:

PubChemData

Smile

CC(CC#N)NC1=C2C=NOC2=NC=N1

DOS

IR

Vibrations