Geometry & MOs

Info

ID:	189866
PubChem CID:	77916591
Reduced:	NO8C44H83 (1)
Stoich.:	AB8C44D83 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	-493.2
Dipole, Da:	1.86
IP(EA), eV:	-9.55(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-[1,3]oxazolo[5,4-d]pyrimidin-7-yl)-4-methyl-3-propan-2-ylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CCCCCCCCCC=CC(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)CCCCCCCCCCCCCC=CCCCCCCCC)O

DOS

IR

Vibrations