Geometry & MOs

Info

ID:	437377
PubChem CID:	135226186
Reduced:	O5C9H10 (1)
Stoich.:	A5B9C10 (1)
Weight, g/mol:	391.078677
ΔH_f, kcal/mol:	-186.75
Dipole, Da:	4.67
IP(EA), eV:	-10.75(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (5R)-5-[[3-(2-chlorophenyl)-2-fluorophenyl]carbamoyl]-3-fluorocyclopentene-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)[C@@H]1CC(=O)C=C1C(=O)OC

DOS

IR

Vibrations