Geometry & MOs

Info

ID:	388905
PubChem CID:	134990565
Reduced:	O3C9H14 (2)
Stoich.:	A3B9C14 (2)
Weight, g/mol:	410.045373
ΔH_f, kcal/mol:	-295.08
Dipole, Da:	2.18
IP(EA), eV:	-9.87(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3R)-3-methylsulfonyloxy-2-(phenylmethoxycarbonylamino)butanoyl]sulfamic acid

Drug info:

PubChemData

Smile

C1CCC2(CC1)OC[C@H](O2)[C@H]3[C@@H]4[C@H](C(O3)O)OC5(O4)CCCCC5

DOS

IR

Vibrations