Geometry & MOs

Info

ID:	312154
PubChem CID:	126603368
Reduced:	O3N5C10H19 (1)
Stoich.:	A3B5C10D19 (1)
Weight, g/mol:	242.090272
ΔH_f, kcal/mol:	-116.88
Dipole, Da:	3.04
IP(EA), eV:	-9.35(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-(4,6-dimethoxypyrimidin-2-yl)oxypropanoate

Drug info:

PubChemData

Smile

CC(C)(C(=O)O)NC(=O)/C(=C\CCN=C(N)N)/N

DOS

IR

Vibrations