Geometry & MOs

Info

ID:	226487
PubChem CID:	87457493
Reduced:	ClSO2N5C25H28 (1)
Stoich.:	ABC2D5E25F28 (1)
Weight, g/mol:	280.124549
ΔH_f, kcal/mol:	-7.8
Dipole, Da:	5.49
IP(EA), eV:	-8.54(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE,R)-N-[[5-(cyclopropylmethoxy)pyridin-2-yl]methylidene]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CN1CCC2=C(C1)SC(=N2)C(=O)N[C@@H]3CCCC[C@@H]3NC(=O)C4=CC5=C(N4)C=CC(=C5)C#C.Cl

DOS

IR

Vibrations