Geometry & MOs

Info

ID:	222756
PubChem CID:	85332408
Reduced:	FS2N3O3C26H34 (1)
Stoich.:	AB2C3D3E26F34 (1)
Weight, g/mol:	519.255333
ΔH_f, kcal/mol:	-157.24
Dipole, Da:	1.4
IP(EA), eV:	-8.6(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(1-benzofuran-2-yl)phenoxy]-4-[tert-butyl(dimethyl)silyl]oxypentan-3-yl]imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)OC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)NCC2CC(CN2)S)C3=CC=C(C=C3)F

DOS

IR

Vibrations