Geometry & MOs

Info

ID:	46209
PubChem CID:	10523205
Reduced:	SO2C23H30 (1)
Stoich.:	AB2C23D30 (1)
Weight, g/mol:	370.232807
ΔH_f, kcal/mol:	-68.31
Dipole, Da:	4.34
IP(EA), eV:	-8.76(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dibutyl-2-[(Z)-2-phenylethenyl]-4-trimethylsilyloxycyclobut-2-en-1-one

Drug info:

PubChemData

Smile

C[C@]12CC=C3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@@]43CCSC5CC5

DOS

IR

Vibrations