Geometry & MOs

Info

ID:	265830
PubChem CID:	103551047
Reduced:	FN2O5C13H13 (1)
Stoich.:	AB2C5D13E13 (1)
Weight, g/mol:	241.131408
ΔH_f, kcal/mol:	-174.38
Dipole, Da:	14.03
IP(EA), eV:	-9.73(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-methyloxolan-3-yl)carbamoyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(CC1C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])F)C(=O)O

DOS

IR

Vibrations