Geometry & MOs

Info

ID:	188766
PubChem CID:	77762962
Reduced:	FN3O3C21H22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	531.15528
ΔH_f, kcal/mol:	-111.86
Dipole, Da:	3.17
IP(EA), eV:	-8.95(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-bromonaphthalen-2-yl)oxy-4-[tert-butyl(dimethyl)silyl]oxypentan-3-yl]-1H-imidazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C(CCOC1=CC=CC(=C1)C2=CC=C(C=C2)F)NC(=O)C3=CN=CN3)O

DOS

IR

Vibrations