Geometry & MOs

Info

ID:	431498
PubChem CID:	135171579
Reduced:	NC7H7 (1)
Stoich.:	AB7C7 (1)
Weight, g/mol:	360.072864
ΔH_f, kcal/mol:	106.98
Dipole, Da:	3.58
IP(EA), eV:	-10.28(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-methoxyphenyl)-2,5-difluoro-4-(2-methoxyphenyl)benzene

Drug info:

PubChemData

Smile

C1CC1(C#N)C2=CC2

DOS

IR

Vibrations