Geometry & MOs

Info

ID:	300251
PubChem CID:	121269966
Reduced:	IN2O3C7H7 (1)
Stoich.:	AB2C3D7E7 (1)
Weight, g/mol:	261.061278
ΔH_f, kcal/mol:	-74.29
Dipole, Da:	5.02
IP(EA), eV:	-9.05(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetylphenyl)-N-(trifluoromethoxy)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=N1)NC(=O)O)I

DOS

IR

Vibrations