Geometry & MOs

Info

ID:	435912
PubChem CID:	135192745
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	337.140197
ΔH_f, kcal/mol:	63.55
Dipole, Da:	4.6
IP(EA), eV:	-8.1(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[1-(1-bicyclo[1.1.1]pentanyl)-4-[6-methyl-5-(trifluoromethyl)pyridin-3-yl]imidazol-2-yl]ethanol

Drug info:

PubChemData

Smile

CCC1=NC(=CN1C23CC(C2)(C3)N4CCOCC4)C5=CN=C(C(=C5)C)N

DOS

IR

Vibrations