Geometry & MOs

Info

ID:	401450
PubChem CID:	135051300
Reduced:	NS2O3C16H19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	255.963079
ΔH_f, kcal/mol:	-90.95
Dipole, Da:	1.41
IP(EA), eV:	-8.3(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,8lambda4-dithiabicyclo[4.3.0]nona-1(6),8-dien-8-yl perchlorate

Drug info:

PubChemData

Smile

CC(CC1=CC2=CC=CC=C2N1C(=O)O)(C=C(SC)SC)O

DOS

IR

Vibrations