Geometry & MOs

Info

ID:	386503
PubChem CID:	134981955
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	438.13784
ΔH_f, kcal/mol:	-104.96
Dipole, Da:	2.94
IP(EA), eV:	-9.54(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(2-bromophenyl)ethyl]-3-methylazulen-2-yl]-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

CC(C)C1=C(C(C2=CC=CC=C21)O)C(=O)OC

DOS

IR

Vibrations