Geometry & MOs

Info

ID:	222520
PubChem CID:	85305367
Reduced:	OSiC23H32 (1)
Stoich.:	ABC23D32 (1)
Weight, g/mol:	352.053608
ΔH_f, kcal/mol:	-0.8
Dipole, Da:	1.84
IP(EA), eV:	-9.19(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(benzenesulfonyl)-2-chloro-1-(2-methoxyphenyl)but-2-en-1-ol

Drug info:

PubChemData

Smile

C[Si](C)(C)C#CC=CCCC#CCCCCCOCC1=CC=CC=C1

DOS

IR

Vibrations