Geometry & MOs

Info

ID:	292951
PubChem CID:	117366162
Reduced:	NOC16H23 (1)
Stoich.:	ABC16D23 (1)
Weight, g/mol:	245.016746
ΔH_f, kcal/mol:	-49.31
Dipole, Da:	2.6
IP(EA), eV:	-8.39(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-chloro-4,5-difluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine

Drug info:

PubChemData

Smile

CC1=C2CCCCC2=CC(=C1C3CCCN3)OC

DOS

IR

Vibrations