Geometry & MOs

Info

ID:	79286
PubChem CID:	49747831
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	261.08235
ΔH_f, kcal/mol:	-19.13
Dipole, Da:	2.86
IP(EA), eV:	-9.36(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(furan-2-yl)-N-(1-thiophen-2-ylpropan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(CC1=CC=CO1)NC(=O)C2(CC2)C#N

DOS

IR

Vibrations