Geometry & MOs

Info

ID:	406865
PubChem CID:	135078809
Reduced:	BrNO3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	351.108228
ΔH_f, kcal/mol:	-56.34
Dipole, Da:	4.28
IP(EA), eV:	-8.76(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-methoxyphenyl)imino-2-[4-(trifluoromethyl)phenyl]acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(=NC1=CC=C(C=C1)OC)C2=CC=C(C=C2)Br

DOS

IR

Vibrations