Geometry & MOs

Info

ID:	371296
PubChem CID:	127345556
Reduced:	SN2O4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	240.147393
ΔH_f, kcal/mol:	-125.25
Dipole, Da:	7.19
IP(EA), eV:	-9.83(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CCC1=C(N=CO1)C(=O)N(C2CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations