Geometry & MOs

Info

ID:	15839
PubChem CID:	453373
Reduced:	N3O3C10H15 (1)
Stoich.:	A3B3C10D15 (1)
Weight, g/mol:	225.111341
ΔH_f, kcal/mol:	-117.48
Dipole, Da:	5.06
IP(EA), eV:	-9.65(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-5-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)N2CC[C@H](C2)CO

DOS

IR

Vibrations