Geometry & MOs

Info

ID:	424111
PubChem CID:	135121361
Reduced:	NPO6C15H32 (1)
Stoich.:	ABC6D15E32 (1)
Weight, g/mol:	260.235145
ΔH_f, kcal/mol:	-385.34
Dipole, Da:	3.48
IP(EA), eV:	-9.38(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl nonanoate;pentan-1-ol

Drug info:

PubChemData

Smile

CCCCCCCCCCC(=O)OCCOP(=O)(O)OCCN

DOS

IR

Vibrations