Geometry & MOs

Info

ID:	143855
PubChem CID:	53270667
Reduced:	N2O3H5F7C14 (1)
Stoich.:	A2B3C5D7E14 (1)
Weight, g/mol:	337.131408
ΔH_f, kcal/mol:	-394.34
Dipole, Da:	7.7
IP(EA), eV:	-10.18(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-phenoxyphenyl)carbamoyl]cyclohexene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C(=O)NC2=C(C(=C(C(=C2F)F)C(F)(F)F)F)F)C(=O)O

DOS

IR

Vibrations