Geometry & MOs

Info

ID:	407519
PubChem CID:	135080265
Reduced:	SiN2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	250.100523
ΔH_f, kcal/mol:	41.27
Dipole, Da:	6.71
IP(EA), eV:	-9.87(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-fluorobutoxy)-4-methylchromen-2-one

Drug info:

PubChemData

Smile

C[Si](C)(C1=CC=CC=C1)[C@H](CC#N)C#N

DOS

IR

Vibrations