Geometry & MOs

Info

ID:	198707
PubChem CID:	79139753
Reduced:	SN2O3C9H14 (1)
Stoich.:	AB2C3D9E14 (1)
Weight, g/mol:	228.089878
ΔH_f, kcal/mol:	-96.69
Dipole, Da:	5.43
IP(EA), eV:	-9.66(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(1-benzofuran-3-yl)-1,3-oxazol-4-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNCC1=C(OC=N1)C2CCS(=O)(=O)C2

DOS

IR

Vibrations