Geometry & MOs

Info

ID:	222105
PubChem CID:	85294133
Reduced:	BrSiO8C27H41 (1)
Stoich.:	ABC8D27E41 (1)
Weight, g/mol:	606.10594
ΔH_f, kcal/mol:	-403.66
Dipole, Da:	3.69
IP(EA), eV:	-8.9(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[tert-butyl(dimethyl)silyl]oxy-1-[3,5-dibromo-4-(pyrrolidin-1-yldiazenyl)phenyl]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1(OCC2C(O1)C(C3C(O2)CCC(C(O3)CO[Si](C)(C)C(C)(C)C)O)OC(=O)C4=CC=C(C=C4)Br)C

DOS

IR

Vibrations