Geometry & MOs

Info

ID:	211374
PubChem CID:	80941106
Reduced:	O2N5C11H15 (1)
Stoich.:	A2B5C11D15 (1)
Weight, g/mol:	265.19026
ΔH_f, kcal/mol:	-68.58
Dipole, Da:	4.97
IP(EA), eV:	-9.46(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-amino-2-ethylpyrimidin-4-yl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)NC2CCC(=O)NC2=O)N

DOS

IR

Vibrations