Geometry & MOs

Info

ID:	387230
PubChem CID:	134984507
Reduced:	ClNO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	303.219829
ΔH_f, kcal/mol:	-73.13
Dipole, Da:	4.41
IP(EA), eV:	-8.72(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R,3S)-1-benzyl-3-(2-methylpropyl)azetidine-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CN(C1)C2=CC(=CC=C2)Cl)C

DOS

IR

Vibrations