Geometry & MOs

Info

ID:	131252
PubChem CID:	51182139
Reduced:	NO5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-170.77
Dipole, Da:	4.96
IP(EA), eV:	-8.41(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-fluorophenyl)-N-[4-(furan-2-yl)butan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(CCC1=CC=CO1)NC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC

DOS

IR

Vibrations