Geometry & MOs

Info

ID:	179776
PubChem CID:	76530057
Reduced:	OSiC8H16 (1)
Stoich.:	ABC8D16 (1)
Weight, g/mol:	276.116173
ΔH_f, kcal/mol:	-60.5
Dipole, Da:	1.08
IP(EA), eV:	-7.36(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4-fluorophenyl)methoxy]-4a,5,6,7,8,8a-hexahydrochromen-4-one

Drug info:

PubChemData

Smile

CCC(C)O[Si]C=C(C)C

DOS

IR

Vibrations