Geometry & MOs

Info

ID:	229839
PubChem CID:	87569336
Reduced:	O2N3F6H19C25 (1)
Stoich.:	A2B3C6D19E25 (1)
Weight, g/mol:	417.125547
ΔH_f, kcal/mol:	-318.59
Dipole, Da:	9.74
IP(EA), eV:	-9.97(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-[2-[[1-[4-(2-chloro-2-fluoroethenyl)phenyl]ethylideneamino]oxymethyl]phenyl]-2-methoxyimino-N-methylacetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(N(C2=O)CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)NCCC4=CC=NC=C4

DOS

IR

Vibrations