Geometry & MOs

Info

ID:	265952
PubChem CID:	103556984
Reduced:	BrN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	276.127406
ΔH_f, kcal/mol:	-2.62
Dipole, Da:	3.16
IP(EA), eV:	-8.98(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NOC(=C2C3=CC=C(C=C3)Br)N

DOS

IR

Vibrations