Geometry & MOs

Info

ID:	225410
PubChem CID:	85756780
Reduced:	NO2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	371.079213
ΔH_f, kcal/mol:	-170.89
Dipole, Da:	4.63
IP(EA), eV:	-9.43(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(2,4-difluorophenoxy)pyrrolidine-2-carboxylate;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC1=NC=C(C(=C1O)CNC(CC(C)C)C(=O)O)CO

DOS

IR

Vibrations