Geometry & MOs

Info

ID:	220950
PubChem CID:	85247938
Reduced:	O5C12H20 (1)
Stoich.:	A5B12C20 (1)
Weight, g/mol:	244.067034
ΔH_f, kcal/mol:	-224.03
Dipole, Da:	3.66
IP(EA), eV:	-10.07(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-pyridin-1-ium-1-ylbenzenecarboximidothioate

Drug info:

PubChemData

Smile

CC(C1C(CC1OCOC)C(=O)OC)C(=O)C

DOS

IR

Vibrations