Geometry & MOs

Info

ID:	28490
PubChem CID:	827969
Reduced:	N2O3H18C19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	274.102751
ΔH_f, kcal/mol:	-97.3
Dipole, Da:	0.85
IP(EA), eV:	-8.86(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,9aS)-2,5,7-trimethyl-9,9a-dihydro-4aH-thioxanthene 10,10-dioxide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C

DOS

IR

Vibrations