Geometry & MOs

Info

ID:	361825
PubChem CID:	127304731
Reduced:	SN3O5C16H19 (1)
Stoich.:	AB3C5D16E19 (1)
Weight, g/mol:	352.145678
ΔH_f, kcal/mol:	-124.14
Dipole, Da:	3.79
IP(EA), eV:	-9.58(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazepane-4-carbonyl)-3,6,6-trimethyl-5,7-dihydro-1H-indol-4-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)COC2=CC=CC=C2C(=O)N3CCCS(=O)(=O)CC3

DOS

IR

Vibrations