Geometry & MOs

Info

ID:	121466
PubChem CID:	50769217
Reduced:	SN2O4C19H26 (1)
Stoich.:	AB2C4D19E26 (1)
Weight, g/mol:	293.152812
ΔH_f, kcal/mol:	-171.87
Dipole, Da:	4.44
IP(EA), eV:	-9.67(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4-[5-[(4-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl]aniline

Drug info:

PubChemData

Smile

CCCNS(=O)(=O)C1=C(C=CC(=C1)CN2C(=O)C3CCCCC3C2=O)C

DOS

IR

Vibrations