Geometry & MOs

Info

ID:	385137
PubChem CID:	134978393
Reduced:	NPO2S2C24H34 (1)
Stoich.:	ABC2D2E24F34 (1)
Weight, g/mol:	423.311361
ΔH_f, kcal/mol:	-154.65
Dipole, Da:	12.41
IP(EA), eV:	-8.3(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-hexoxydecyl 2-(trimethylazaniumyl)ethyl phosphate

Drug info:

PubChemData

Smile

C1CCC(CC1)[NH2+]C2CCCCC2.C1=CC=C(C=C1)SP(=O)([O-])SC2=CC=CC=C2

DOS

IR

Vibrations