Geometry & MOs

Info

ID:	305592
PubChem CID:	124961121
Reduced:	O3N4C18H24 (1)
Stoich.:	A3B4C18D24 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-91.81
Dipole, Da:	5.31
IP(EA), eV:	-8.13(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3R)-3-hydroxy-1-pyrimidin-2-ylpyrrolidin-3-yl]methyl]-N-methyl-2-pyrrolidin-1-ylacetamide

Drug info:

PubChemData

Smile

CC(C)N1CCN(C[C@@H]1C(=O)N)C(=O)C2=CC3=C(N2)C=CC=C3OC

DOS

IR

Vibrations