Geometry & MOs

Info

ID:	372474
PubChem CID:	131298232
Reduced:	BN3O4C22H36 (1)
Stoich.:	AB3C4D22E36 (1)
Weight, g/mol:	287.9932
ΔH_f, kcal/mol:	-281.04
Dipole, Da:	6.17
IP(EA), eV:	-8.45(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromopyridin-4-yl)methylidene]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2C)N3CCC(CC3)NC(=O)OC(C)(C)C

DOS

IR

Vibrations