Geometry & MOs

Info

ID:	191532
PubChem CID:	78159539
Reduced:	O2N4C19H20 (1)
Stoich.:	A2B4C19D20 (1)
Weight, g/mol:	232.14633
ΔH_f, kcal/mol:	27.95
Dipole, Da:	2.73
IP(EA), eV:	-8.64(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hex-1-enyl-6-methyl-6,7-dihydro-5H-1-benzofuran-4-one

Drug info:

PubChemData

Smile

CC(=O)C(=NNC1=CC=CC=C1)CC(=NNC2=CC=CC=C2)C(=O)C

DOS

IR

Vibrations