Geometry & MOs

Info

ID:	230195
PubChem CID:	87570399
Reduced:	O2N6H14C15 (1)
Stoich.:	A2B6C14D15 (1)
Weight, g/mol:	254.118104
ΔH_f, kcal/mol:	24.59
Dipole, Da:	5.27
IP(EA), eV:	-8.78(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1R,2S)-1-benzyl-2-phenylaziridin-1-ium-1-carboxylic acid

Drug info:

PubChemData

Smile

CCOC1=NC(=NC2=NC=C(N=C21)C3=CC=C(C=C3)NC=O)N

DOS

IR

Vibrations