Geometry & MOs

Info

ID:	311376
PubChem CID:	126591247
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	231.121906
ΔH_f, kcal/mol:	-27.22
Dipole, Da:	4.39
IP(EA), eV:	-9.4(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[3-(methoxyamino)peroxy-2-nitrosoprop-1-enyl]-1-propylaziridine

Drug info:

PubChemData

Smile

CC/1C=CC/C(=C\C(NC(=O)/C=C1)C)/C

DOS

IR

Vibrations