Geometry & MOs

Info

ID:	194267
PubChem CID:	78506178
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	334.005802
ΔH_f, kcal/mol:	-58.84
Dipole, Da:	5.07
IP(EA), eV:	-8.96(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dichlorophenyl)-2-[(5-oxo-1,2,4-triazinan-3-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CN(C)CCOC(=O)C1C(C(NNC1=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations