Geometry & MOs

Info

ID:	275091
PubChem CID:	103813751
Reduced:	OF3N3C12H20 (1)
Stoich.:	AB3C3D12E20 (1)
Weight, g/mol:	227.199762
ΔH_f, kcal/mol:	-219.55
Dipole, Da:	7.3
IP(EA), eV:	-9.35(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

C1C[C@@H](NC1)C(=O)NCC2CCN(C2)CC(F)(F)F

DOS

IR

Vibrations