Geometry & MOs

Info

ID:	195556
PubChem CID:	78699960
Reduced:	SO4H14C16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	415.215887
ΔH_f, kcal/mol:	-96.67
Dipole, Da:	6.5
IP(EA), eV:	-9.47(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenoxy)ethyl 1-(adamantane-1-carbonyl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=CC=C2)O

DOS

IR

Vibrations