Geometry & MOs

Info

ID:	194199
PubChem CID:	78497036
Reduced:	O2S2N4C15H18 (1)
Stoich.:	A2B2C4D15E18 (1)
Weight, g/mol:	364.102768
ΔH_f, kcal/mol:	-44.42
Dipole, Da:	2.02
IP(EA), eV:	-9.18(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-ethyl-6-oxo-1,3-diazinan-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CCC1CC(=O)NC(N1)SCC(=O)NC2=NC3=CC=CC=C3S2

DOS

IR

Vibrations