Geometry & MOs

Info

ID:	195871
PubChem CID:	78744613
Reduced:	SN2O5C20H24 (1)
Stoich.:	AB2C5D20E24 (1)
Weight, g/mol:	301.040879
ΔH_f, kcal/mol:	-177.9
Dipole, Da:	11.78
IP(EA), eV:	-9.25(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(furan-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N(C)C)C

DOS

IR

Vibrations