Geometry & MOs

Info

ID:	375763
PubChem CID:	134221753
Reduced:	N2O13C33H44 (1)
Stoich.:	A2B13C33D44 (1)
Weight, g/mol:	195.046633
ΔH_f, kcal/mol:	-433.0
Dipole, Da:	4.47
IP(EA), eV:	-8.59(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[methyl-(5-methylpyridin-2-yl)-oxo-lambda6-sulfanylidene]cyanamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H](C3CON=C3C4=CC5=C(C=C24)OCO5)C(NCCOCCOCCOCCOCCC(=O)O)O

DOS

IR

Vibrations