Geometry & MOs

Info

ID:	390551
PubChem CID:	134999682
Reduced:	FNSO3C15H16 (1)
Stoich.:	ABCD3E15F16 (1)
Weight, g/mol:	326.164696
ΔH_f, kcal/mol:	-139.75
Dipole, Da:	3.35
IP(EA), eV:	-8.77(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-diethoxyphosphoryl-1-phenylheptan-1-one

Drug info:

PubChemData

Smile

C=CCS[C@H](CC(=O)N1CCOC1=O)C2=CC=CC=C2F

DOS

IR

Vibrations