Geometry & MOs

Info

ID:	223355
PubChem CID:	85334905
Reduced:	SN3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	234.121572
ΔH_f, kcal/mol:	46.43
Dipole, Da:	6.07
IP(EA), eV:	-8.66(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4,5-trihydroxy-6-methoxyoxan-2-yl)propanimidamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C=NNC(=S)N

DOS

IR

Vibrations