Geometry & MOs

Info

ID:	447658
PubChem CID:	135284507
Reduced:	NO4C15H27 (1)
Stoich.:	AB4C15D27 (1)
Weight, g/mol:	386.175419
ΔH_f, kcal/mol:	-220.83
Dipole, Da:	1.85
IP(EA), eV:	-9.66(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S)-5-(2-fluoro-4-pyrazolo[1,5-a]pyrimidin-7-ylphenoxy)-2,4-dimethylpentan-2-yl] carbamate

Drug info:

PubChemData

Smile

CC(=C)CC1(COC(N1C(=O)OC(C)(C)C)(C)C)CO

DOS

IR

Vibrations