Geometry & MOs

Info

ID:	200842
PubChem CID:	79452563
Reduced:	BrN3C14H24 (1)
Stoich.:	AB3C14D24 (1)
Weight, g/mol:	231.1987
ΔH_f, kcal/mol:	16.51
Dipole, Da:	4.47
IP(EA), eV:	-8.97(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-propan-2-ylphenyl)methyl]-3-propylazetidine

Drug info:

PubChemData

Smile

CCCC1(CNC1)CC2=C(C(=NN2CC)CC)Br

DOS

IR

Vibrations