Geometry & MOs

Info

ID:	406633
PubChem CID:	135078234
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	247.133907
ΔH_f, kcal/mol:	-67.8
Dipole, Da:	2.92
IP(EA), eV:	-9.44(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(5-chloropentyl)aziridine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC1CCC2=CC=CC=C2

DOS

IR

Vibrations