Geometry & MOs

Info

ID:	341153
PubChem CID:	127263588
Reduced:	ClN2O2C11H21 (1)
Stoich.:	AB2C2D11E21 (1)
Weight, g/mol:	248.129156
ΔH_f, kcal/mol:	-127.66
Dipole, Da:	6.89
IP(EA), eV:	-9.58(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-(azetidin-3-yl)cyclopropyl]carbamate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC2CNC2C1.Cl

DOS

IR

Vibrations