Geometry & MOs

Info

ID:	441470
PubChem CID:	135235169
Reduced:	N4O8C21H28 (1)
Stoich.:	A4B8C21D28 (1)
Weight, g/mol:	428.139943
ΔH_f, kcal/mol:	-329.73
Dipole, Da:	5.39
IP(EA), eV:	-9.53(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-1-[[2-fluoro-4-[(2E,4E)-5-fluorohexa-2,4-dien-2-yl]phenoxy]methoxy]-4-(4-fluorophenyl)benzene

Drug info:

PubChemData

Smile

CC(NC(=O)/C=C\C(=O)O)N1CCC(C1=O)/C(=C/C(=O)OC)/C(=O)NC(C)N2CCCC2=O

DOS

IR

Vibrations