Geometry & MOs

Info

ID:	295135
PubChem CID:	117518285
Reduced:	BrN2O3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	352.04226
ΔH_f, kcal/mol:	-52.64
Dipole, Da:	5.46
IP(EA), eV:	-8.57(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-bromo-4-cyclopentyloxy-5-methoxyphenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CC(C)C1=C2C(=CC(=C1C3=NOC(=C3)N)Br)OCCCO2

DOS

IR

Vibrations