Geometry & MOs

Info

ID:	5125
PubChem CID:	12632
Reduced:	O2H8C9 (1)
Stoich.:	A2B8C9 (1)
Weight, g/mol:	148.052429
ΔH_f, kcal/mol:	-50.93
Dipole, Da:	2.87
IP(EA), eV:	-9.22(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-1-benzofuran-3-one

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)CO2

DOS

IR

Vibrations