Geometry & MOs

Info

ID:	173191
PubChem CID:	75608084
Reduced:	N3O8C21H25 (1)
Stoich.:	A3B8C21D25 (1)
Weight, g/mol:	385.128963
ΔH_f, kcal/mol:	-271.83
Dipole, Da:	7.23
IP(EA), eV:	-8.78(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethylphenyl)-3-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OC)N2C=C(N=N2)C3=CC=CC=C3)OC(=O)C)OC(=O)C

DOS

IR

Vibrations