Geometry & MOs

Info

ID:	200839
PubChem CID:	79451220
Reduced:	ClN3C14H24 (1)
Stoich.:	AB3C14D24 (1)
Weight, g/mol:	203.1674
ΔH_f, kcal/mol:	5.3
Dipole, Da:	3.35
IP(EA), eV:	-9.0(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3,4-dimethylphenyl)methyl]-3-ethylazetidine

Drug info:

PubChemData

Smile

CCN1C(=C(C(=N1)C)Cl)CC2(CNC2)CC(C)C

DOS

IR

Vibrations