Geometry & MOs

Info

ID:	268784
PubChem CID:	103600905
Reduced:	BrNOC9H10 (1)
Stoich.:	ABCD9E10 (1)
Weight, g/mol:	276.082016
ΔH_f, kcal/mol:	15.02
Dipole, Da:	1.43
IP(EA), eV:	-9.61(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(furan-2-ylmethylsulfanyl)-2-phenylacetate

Drug info:

PubChemData

Smile

CC/C(=N/O)/C1=CC(=CC=C1)Br

DOS

IR

Vibrations