Geometry & MOs

Info

ID:	393452
PubChem CID:	135020624
Reduced:	O2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	332.03155
ΔH_f, kcal/mol:	-66.2
Dipole, Da:	4.9
IP(EA), eV:	-9.3(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-6-methyl-3-methylselanyl-4-phenyl-3,4-dihydrochromen-2-one

Drug info:

PubChemData

Smile

C1CCOC2=C(C1)C=CC3=C2CCC3=O

DOS

IR

Vibrations