Geometry & MOs

Info

ID:	231188
PubChem CID:	87572908
Reduced:	PO2F3C16H32 (1)
Stoich.:	AB2C3D16E32 (1)
Weight, g/mol:	170.069142
ΔH_f, kcal/mol:	-350.71
Dipole, Da:	11.65
IP(EA), eV:	-9.86(1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetyl acetate;1H-imidazole

Drug info:

PubChemData

Smile

CCCCCCCCP(CC)(CC)(CC)OC(=O)C(F)(F)F

DOS

IR

Vibrations