Geometry & MOs

Info

ID:	200898
PubChem CID:	79459956
Reduced:	N3C17H23 (1)
Stoich.:	A3B17C23 (1)
Weight, g/mol:	259.23
ΔH_f, kcal/mol:	54.58
Dipole, Da:	3.38
IP(EA), eV:	-9.03(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylphenyl)-3-octylazetidine

Drug info:

PubChemData

Smile

CCN1C(=CC(=N1)C)CC2(CNC2)C3=CC=CC=C3C

DOS

IR

Vibrations