Geometry & MOs

Info

ID:	121971
PubChem CID:	50788572
Reduced:	SN3O4C18H29 (1)
Stoich.:	AB3C4D18E29 (1)
Weight, g/mol:	409.203528
ΔH_f, kcal/mol:	-165.23
Dipole, Da:	6.2
IP(EA), eV:	-9.0(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxolan-2-ylmethyl)-N-(2-oxo-2-piperazin-1-ylethyl)-4-propan-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)S(=O)(=O)N(CCOC)CC(=O)N2CCNCC2)C

DOS

IR

Vibrations