Geometry & MOs

Info

ID:	227053
PubChem CID:	87559929
Reduced:	FSN3H8C10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	316.105922
ΔH_f, kcal/mol:	82.88
Dipole, Da:	4.74
IP(EA), eV:	-8.5(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-prop-2-ynoxyacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN2C=CC(=N2)N=S)F

DOS

IR

Vibrations