Geometry & MOs

Info

ID:	399110
PubChem CID:	135037835
Reduced:	NF2O2C11H19 (1)
Stoich.:	AB2C2D11E19 (1)
Weight, g/mol:	312.266445
ΔH_f, kcal/mol:	-193.39
Dipole, Da:	2.22
IP(EA), eV:	-9.36(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,5S)-5-[(1S)-1-hydroxydec-9-enyl]-2-pentyloxolan-3-ol

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C(C)C)NCC=C)(F)F

DOS

IR

Vibrations