Geometry & MOs

Info

ID:	387314
PubChem CID:	134984880
Reduced:	NCl2H13C15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	319.142612
ΔH_f, kcal/mol:	51.73
Dipole, Da:	3.15
IP(EA), eV:	-8.76(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R,3S)-1-[(R)-tert-butylsulfinyl]-3-phenylaziridin-2-yl]ethynyl-trimethylsilane

Drug info:

PubChemData

Smile

C[C@H]1[C@H](N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations