Geometry & MOs

Info

ID:	58853
PubChem CID:	24714971
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	293.093104
ΔH_f, kcal/mol:	-62.32
Dipole, Da:	3.17
IP(EA), eV:	-8.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylamino]-2-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

CC(CN(C)CC1=NC2=C(C3=C(S2)CCC3)C(=O)N1)O

DOS

IR

Vibrations