Geometry & MOs

Info

ID:	368221
PubChem CID:	127327772
Reduced:	OSN4C12H20 (1)
Stoich.:	ABC4D12E20 (1)
Weight, g/mol:	373.203528
ΔH_f, kcal/mol:	-6.52
Dipole, Da:	8.4
IP(EA), eV:	-9.49(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylazepan-1-yl)-N-[(1,1-dioxothiolan-3-yl)carbamoyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1CCN(CC1)C(=O)NC2=NN=CS2

DOS

IR

Vibrations