Geometry & MOs

Info

ID:	6168
PubChem CID:	67345
Reduced:	NSO5C14H29 (1)
Stoich.:	ABC5D14E29 (1)
Weight, g/mol:	323.176644
ΔH_f, kcal/mol:	-265.41
Dipole, Da:	3.59
IP(EA), eV:	-10.2(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dodecanoylamino)ethyl hydrogen sulfate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)NCCOS(=O)(=O)O

DOS

IR

Vibrations