Geometry & MOs

Info

ID:	266163
PubChem CID:	103558609
Reduced:	BrN2O2C9H13 (1)
Stoich.:	AB2C2D9E13 (1)
Weight, g/mol:	308.00217
ΔH_f, kcal/mol:	-23.9
Dipole, Da:	3.83
IP(EA), eV:	-9.45(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=C(C(=NO2)N)Br

DOS

IR

Vibrations