Geometry & MOs

Info

ID:	68605
PubChem CID:	46508746
Reduced:	N4O5C23H34 (1)
Stoich.:	A4B5C23D34 (1)
Weight, g/mol:	410.110042
ΔH_f, kcal/mol:	-212.15
Dipole, Da:	7.63
IP(EA), eV:	-8.81(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(5-acetamido-2-methoxyphenyl)-3-[5-(4-fluorophenyl)thiophen-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C(C)OC2=CC=C(C=C2)OC

DOS

IR

Vibrations