Geometry & MOs

Info

ID:	188724
PubChem CID:	77759554
Reduced:	SN3O6C16H17 (1)
Stoich.:	AB3C6D16E17 (1)
Weight, g/mol:	402.073576
ΔH_f, kcal/mol:	-196.02
Dipole, Da:	2.2
IP(EA), eV:	-9.09(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C=CC(=O)N2CCC3C2C(=O)N3S(=O)(=O)O

DOS

IR

Vibrations