Geometry & MOs

Info

ID:	415858
PubChem CID:	135088860
Reduced:	NO3C24H29 (1)
Stoich.:	AB3C24D29 (1)
Weight, g/mol:	337.054194
ΔH_f, kcal/mol:	-91.98
Dipole, Da:	5.6
IP(EA), eV:	-9.1(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[[5-(2,6-difluorophenyl)-1,2,4-oxadiazol-3-yl]methyl]-2-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC2(CCN(CC2)C(=O)CC(CC3=CC=CC=C3)C4=CC=CO4)OCC1

DOS

IR

Vibrations