Geometry & MOs

Info

ID:	201565
PubChem CID:	79557291
Reduced:	FION2H8C10 (1)
Stoich.:	ABCD2E8F10 (1)
Weight, g/mol:	393.88139
ΔH_f, kcal/mol:	8.89
Dipole, Da:	2.84
IP(EA), eV:	-9.38(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-bromo-4-methoxyphenyl)-4-iodo-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=C(C(=NO2)N)I)F

DOS

IR

Vibrations