Geometry & MOs

Info

ID:	155040
PubChem CID:	56314831
Reduced:	SN2O5C21H32 (1)
Stoich.:	AB2C5D21E32 (1)
Weight, g/mol:	470.102683
ΔH_f, kcal/mol:	-199.62
Dipole, Da:	7.23
IP(EA), eV:	-8.68(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-[4-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]piperazin-1-yl]-2-oxoethyl]-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCCN2C(=O)C3=CC=C(C=C3)S(=O)(=O)CCOC

DOS

IR

Vibrations