Geometry & MOs

Info

ID:	175453
PubChem CID:	75907475
Reduced:	N2O5C21H30 (1)
Stoich.:	A2B5C21D30 (1)
Weight, g/mol:	401.200237
ΔH_f, kcal/mol:	-228.6
Dipole, Da:	4.31
IP(EA), eV:	-9.75(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-fluorophenyl)methyl 1-(adamantane-1-carbonyl)-4-hydroxypyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C1CC1NC(=O)COC(=O)C2CC(CN2C(=O)C34CC5CC(C3)CC(C5)C4)O

DOS

IR

Vibrations