Geometry & MOs

Info

ID:	272579
PubChem CID:	103748501
Reduced:	O2N3C16H33 (1)
Stoich.:	A2B3C16D33 (1)
Weight, g/mol:	326.13972
ΔH_f, kcal/mol:	-144.68
Dipole, Da:	1.75
IP(EA), eV:	-8.52(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2-chloro-6-methoxyphenyl)methylamino]azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC(CC)(CNC1CCN(C1)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations