Geometry & MOs

Info

ID:	220563
PubChem CID:	85197824
Reduced:	OSC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	330.201507
ΔH_f, kcal/mol:	-35.33
Dipole, Da:	2.11
IP(EA), eV:	-8.88(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]phenyl]cyclopentan-1-one

Drug info:

PubChemData

Smile

CC(C)(C(=CC(=O)SC1=CC=CC=C1)SC2=CC=CC=C2)O

DOS

IR

Vibrations