Geometry & MOs

Info

ID:	206312
PubChem CID:	80228887
Reduced:	BrNS2H12C15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	234.061612
ΔH_f, kcal/mol:	66.05
Dipole, Da:	2.62
IP(EA), eV:	-8.55(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-ethoxypyridin-3-yl)-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

CC1=CSC=C1C2=NC(=C(S2)C)C3=CC=CC=C3Br

DOS

IR

Vibrations