Geometry & MOs

Info

ID:	240735
PubChem CID:	93617231
Reduced:	OSN2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	305.119798
ΔH_f, kcal/mol:	39.08
Dipole, Da:	3.19
IP(EA), eV:	-8.97(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-6-[[(2R)-2-thiophen-3-ylpyrrolidin-1-yl]methyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CN2CCC[C@H]2C3=CSC=C3

DOS

IR

Vibrations