Geometry & MOs

Info

ID:	48261
PubChem CID:	10538415
Reduced:	SiO2C13H30 (1)
Stoich.:	AB2C13D30 (1)
Weight, g/mol:	247.0667
ΔH_f, kcal/mol:	-195.39
Dipole, Da:	0.53
IP(EA), eV:	-8.8(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dimethyl-4,5-dihydrofuro[3,4-b][1,5]benzothiazepin-3-one

Drug info:

PubChemData

Smile

C[C@@H](CCO[Si](C)(C)C(C)(C)C)C[C@@H](C)O

DOS

IR

Vibrations