Geometry & MOs

Info

ID:	266161
PubChem CID:	103558603
Reduced:	BrN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-6.14
Dipole, Da:	3.58
IP(EA), eV:	-8.82(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1-methoxycyclobutyl)methyl]-4-propyl-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=C(C(=NO2)N)C3=CC=CC=C3Br

DOS

IR

Vibrations