Geometry & MOs

Info

ID:	308597
PubChem CID:	126497119
Reduced:	ClN3O3C14H20 (1)
Stoich.:	AB3C3D14E20 (1)
Weight, g/mol:	183.056529
ΔH_f, kcal/mol:	-138.9
Dipole, Da:	6.9
IP(EA), eV:	-9.04(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-aminopentan-2-yl] hydrogen sulfate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N[C@@H](C)C(=O)NC1=CC(=CC(=C1)CCl)CO)N

DOS

IR

Vibrations