Geometry & MOs

Info

ID:	387337
PubChem CID:	134984984
Reduced:	FNSCl3O4C13H15 (1)
Stoich.:	ABCD3E4F13G15 (1)
Weight, g/mol:	358.168128
ΔH_f, kcal/mol:	-208.5
Dipole, Da:	3.84
IP(EA), eV:	-10.14(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S,3R)-1-benzhydryl-3-pyridin-2-ylaziridine-2-carboxylate

Drug info:

PubChemData

Smile

CCC(C)(C(=O)C1=CC=C(C=C1)F)NS(=O)(=O)OCC(Cl)(Cl)Cl

DOS

IR

Vibrations