Geometry & MOs

Info

ID:	349299
PubChem CID:	127275086
Reduced:	SO2N3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-81.32
Dipole, Da:	3.11
IP(EA), eV:	-8.44(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(2-methyl-1,4-oxazepan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC(=O)NC2=NC3=C(S2)CCCC3

DOS

IR

Vibrations