Geometry & MOs

Info

ID:	435917
PubChem CID:	135192762
Reduced:	OF3N3C19H20 (1)
Stoich.:	AB3C3D19E20 (1)
Weight, g/mol:	284.163711
ΔH_f, kcal/mol:	-77.93
Dipole, Da:	6.47
IP(EA), eV:	-9.1(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(6-amino-5-methylpyridin-3-yl)-1-(1-bicyclo[1.1.1]pentanyl)imidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=N1)C2=CN(C(=N2)C(C3CC3)O)C45CC(C4)C5)C(F)(F)F

DOS

IR

Vibrations