Geometry & MOs

Info

ID:	150345
PubChem CID:	53790033
Reduced:	OF3N8H9C20 (1)
Stoich.:	AB3C8D9E20 (1)
Weight, g/mol:	132.11503
ΔH_f, kcal/mol:	82.35
Dipole, Da:	3.99
IP(EA), eV:	-9.22(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-3-methylpentan-3-ol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=NN=C(N3C4=CN(C(N24)F)C#N)C5=NC(=NO5)C6=C(C=C(C=C6)F)F

DOS

IR

Vibrations