Geometry & MOs

Info

ID:	294544
PubChem CID:	117468808
Reduced:	N2O5C14H14 (1)
Stoich.:	A2B5C14D14 (1)
Weight, g/mol:	290.042436
ΔH_f, kcal/mol:	-157.1
Dipole, Da:	5.36
IP(EA), eV:	-9.65(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3,5-difluoro-4-methylsulfonylphenyl)cyclopropyl]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)C1=CC=C(C=C1)N2CCNC(=O)C2=O

DOS

IR

Vibrations