Geometry & MOs

Info

ID:	191291
PubChem CID:	78125982
Reduced:	FSN2O5C13H19 (1)
Stoich.:	ABC2D5E13F19 (1)
Weight, g/mol:	330.010891
ΔH_f, kcal/mol:	-267.7
Dipole, Da:	5.87
IP(EA), eV:	-9.07(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

N-hydroxy-N'-(8-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)methanimidamide;manganese(2+)

Drug info:

PubChemData

Smile

CCC1CN(C(=O)NC1=S)C2C(C(C(O2)COC(=O)C)O)F

DOS

IR

Vibrations