Geometry & MOs

Info

ID:	430527
PubChem CID:	135170593
Reduced:	NO5C8H11 (1)
Stoich.:	AB5C8D11 (1)
Weight, g/mol:	181.035063
ΔH_f, kcal/mol:	-181.2
Dipole, Da:	4.27
IP(EA), eV:	-9.84(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-1-methyl-4-(trifluoromethyl)-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CN1C(C(=CC1=O)OC)OC(=O)OC

DOS

IR

Vibrations