Geometry & MOs

Info

ID:	266160
PubChem CID:	103558601
Reduced:	ClFN2O2C15H16 (1)
Stoich.:	ABC2D2E15F16 (1)
Weight, g/mol:	336.04734
ΔH_f, kcal/mol:	-58.16
Dipole, Da:	3.24
IP(EA), eV:	-9.32(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=C(C(=NO2)N)C3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations