Geometry & MOs

Info

ID:	165829
PubChem CID:	74602690
Reduced:	SO4N5C24H25 (1)
Stoich.:	AB4C5D24E25 (1)
Weight, g/mol:	164.092283
ΔH_f, kcal/mol:	-67.58
Dipole, Da:	2.66
IP(EA), eV:	-9.19(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]methylazanium

Drug info:

PubChemData

Smile

CCN1C(=O)C(C(N(C1=O)CC2=CC=CC=C2)N)C(=O)CSC3=NN=C(O3)C4=CC=CC=C4C

DOS

IR

Vibrations