Geometry & MOs

Info

ID:	225660
PubChem CID:	87225333
Reduced:	S2O3N5C21H21 (1)
Stoich.:	A2B3C5D21E21 (1)
Weight, g/mol:	269.062515
ΔH_f, kcal/mol:	2.47
Dipole, Da:	1.04
IP(EA), eV:	-8.38(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CS(CCN1C2=NC=CN=C2OC3=CC=C(C=C3)NC4=NC5=CC=CC=C5S4)(O)O

DOS

IR

Vibrations