Geometry & MOs

Info

ID:	399843
PubChem CID:	135043122
Reduced:	OC15H21 (1)
Stoich.:	AB15C21 (1)
Weight, g/mol:	275.064663
ΔH_f, kcal/mol:	10.74
Dipole, Da:	1.84
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.761296
Charge, e:	0

Chem-info

IUPAC name:

3-azido-3-diethoxyphosphoryl-1,1,1-trifluoropropane

Drug info:

PubChemData

Smile

CC(C)(CCC[C@H]1C[C@@H]1C2=CC=CC=C2)[O]

DOS

IR

Vibrations