Geometry & MOs

Info

ID:	194834
PubChem CID:	78596440
Reduced:	BrFON2H14C16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	396.128549
ΔH_f, kcal/mol:	-11.49
Dipole, Da:	5.59
IP(EA), eV:	-9.21(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[4-[[(2,4-difluorophenyl)hydrazinylidene]methyl]phenoxy]methyl]benzoate

Drug info:

PubChemData

Smile

CCC(=NNC(=O)C1=CC=C(C=C1)Br)C2=CC=C(C=C2)F

DOS

IR

Vibrations