Geometry & MOs

Info

ID:	229624
PubChem CID:	87568226
Reduced:	PO4C11H23 (1)
Stoich.:	AB4C11D23 (1)
Weight, g/mol:	311.246044
ΔH_f, kcal/mol:	-273.75
Dipole, Da:	5.59
IP(EA), eV:	-10.61(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(methoxymethyl)pyrrolidin-1-yl]dodecane-1,3-dione

Drug info:

PubChemData

Smile

CCCCC(CC)(CC)C(=O)CP(=O)(O)O

DOS

IR

Vibrations