Geometry & MOs

Info

ID:	9280
PubChem CID:	87695
Reduced:	O4C15H16 (1)
Stoich.:	A4B15C16 (1)
Weight, g/mol:	260.104859
ΔH_f, kcal/mol:	-133.7
Dipole, Da:	5.65
IP(EA), eV:	-8.91(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-hydroxy-3-methylbut-1-enyl)-7-methoxychromen-2-one

Drug info:

PubChemData

Smile

CC(C)(C=CC1=C(C=C2C(=C1)C=CC(=O)O2)OC)O

DOS

IR

Vibrations