Geometry & MOs

Info

ID:	20265
PubChem CID:	582838
Reduced:	N3F4O6H9C11 (1)
Stoich.:	A3B4C6D9E11 (1)
Weight, g/mol:	355.042748
ΔH_f, kcal/mol:	-271.43
Dipole, Da:	4.92
IP(EA), eV:	-11.11(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,3,3-tetrafluoro-2-methoxy-N-(2-methyl-3,5-dinitrophenyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(C(F)(F)F)(OC)F

DOS

IR

Vibrations