Geometry & MOs

Info

ID:	338420
PubChem CID:	127259112
Reduced:	N2O3C10H14 (1)
Stoich.:	A2B3C10D14 (1)
Weight, g/mol:	213.057198
ΔH_f, kcal/mol:	-112.23
Dipole, Da:	3.51
IP(EA), eV:	-9.73(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminopyrimidin-2-yl)sulfanylethyl acetate

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)OCCOC(=O)C)C

DOS

IR

Vibrations