Geometry & MOs

Info

ID:	275038
PubChem CID:	103813337
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	17.43
Dipole, Da:	4.21
IP(EA), eV:	-9.16(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)NCCC2=NN=C3N2C=CC=C3

DOS

IR

Vibrations