Geometry & MOs

Info

ID:	285699
PubChem CID:	104120110
Reduced:	NOC6H10 (2)
Stoich.:	ABC6D10 (2)
Weight, g/mol:	326.00662
ΔH_f, kcal/mol:	-73.6
Dipole, Da:	2.96
IP(EA), eV:	-9.22(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(4-bromo-3-fluorophenoxy)-1,3-oxazol-4-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC1CCC(CC1C)OC2=NC(=CO2)CN

DOS

IR

Vibrations