Geometry & MOs

Info

ID:	312389
PubChem CID:	126604568
Reduced:	N2O2F6H24C31 (1)
Stoich.:	A2B2C6D24E31 (1)
Weight, g/mol:	272.198759
ΔH_f, kcal/mol:	-307.05
Dipole, Da:	5.69
IP(EA), eV:	-9.02(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(cyclopropylmethoxy)-3-[(2R)-2-methoxypropoxy]propan-2-yl]oxymethylcyclopropane

Drug info:

PubChemData

Smile

C1C2=C(C=CC(=C2)CC3=CC4=C(C=C3)OCN(C4)C5=CC=C(C=C5)C(F)(F)F)OCN1C6=CC=C(C=C6)C(F)(F)F

DOS

IR

Vibrations