Geometry & MOs

Info

ID:	75040
PubChem CID:	48422909
Reduced:	SN2O4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-136.83
Dipole, Da:	6.13
IP(EA), eV:	-8.37(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[2-(1-phenylpyrazol-4-yl)ethylamino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)NS(=O)(=O)C)OCC2CC2

DOS

IR

Vibrations