Geometry & MOs

Info

ID:	360601
PubChem CID:	127301246
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	328.182064
ΔH_f, kcal/mol:	-119.58
Dipole, Da:	4.1
IP(EA), eV:	-9.29(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cycloheptyl-2-[cyclopropyl-(1,1-dioxothiolan-3-yl)amino]acetamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCN(C2CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations