Geometry & MOs

Info

ID:	201279
PubChem CID:	79518252
Reduced:	SN2O2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	277.088498
ΔH_f, kcal/mol:	-88.5
Dipole, Da:	3.81
IP(EA), eV:	-8.3(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-4-methoxyaniline

Drug info:

PubChemData

Smile

CCCC(C)NC(=O)CSC1=C(C=CC(=C1)OC)N

DOS

IR

Vibrations