Geometry & MOs

Info

ID:	265829
PubChem CID:	103550944
Reduced:	NO4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	296.08085
ΔH_f, kcal/mol:	-211.36
Dipole, Da:	6.04
IP(EA), eV:	-10.12(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-fluoro-4-nitrophenyl)carbamoyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(CCCO)NC(=O)C1CCC(C1)C(=O)O

DOS

IR

Vibrations