Geometry & MOs

Info

ID:	226901
PubChem CID:	87558859
Reduced:	SO2N5F6H23C26 (1)
Stoich.:	AB2C5D6E23F26 (1)
Weight, g/mol:	515.9274
ΔH_f, kcal/mol:	-263.99
Dipole, Da:	2.24
IP(EA), eV:	-9.15(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[2-[[2-chloro-4-(2,2-dibromoethenyl)phenoxy]methyl]phenyl]-2-methoxyimino-N-methylacetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC(=CS2)C3=NO[C@@]4(C3)CCC5=CC=CC=C45)C(=O)CN6C(=CC(=N6)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations