Geometry & MOs

Info

ID:	217076
PubChem CID:	85087210
Reduced:	N2O8C13H18 (1)
Stoich.:	A2B8C13D18 (1)
Weight, g/mol:	330.157166
ΔH_f, kcal/mol:	-230.25
Dipole, Da:	4.87
IP(EA), eV:	-10.5(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[di(propan-2-yloxy)phosphorylmethyl]-1,1,1-trifluoro-3-methylhex-2-ene

Drug info:

PubChemData

Smile

CCCCOC1CC2(C(=O)C(=[N+](N2O1)[O-])C(=O)OC)C(=O)OC

DOS

IR

Vibrations