Geometry & MOs

Info

ID:	69879
PubChem CID:	47205671
Reduced:	SN2O4C12H18 (1)
Stoich.:	AB2C4D12E18 (1)
Weight, g/mol:	297.088019
ΔH_f, kcal/mol:	-142.82
Dipole, Da:	4.93
IP(EA), eV:	-10.04(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(3-chlorobenzoyl)hydrazinyl]-2-oxoethyl]butanamide

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)C2=CC=C(O2)S(=O)(=O)N

DOS

IR

Vibrations