Geometry & MOs

Info

ID:	188957
PubChem CID:	77794029
Reduced:	SiO2N4C23H34 (1)
Stoich.:	AB2C4D23E34 (1)
Weight, g/mol:	507.097969
ΔH_f, kcal/mol:	-98.18
Dipole, Da:	2.05
IP(EA), eV:	-8.32(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(5-chloro-2-methylphenyl)hepta-3,6-dienyl]-5-(4-chlorophenyl)-2-(trifluoromethyl)furan-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N1CCC(CO[Si](C)(C)C(C)(C)C)NC(=O)C3=CN=CN3

DOS

IR

Vibrations