Geometry & MOs

Info

ID:	78510
PubChem CID:	49693441
Reduced:	SN3O4C18H25 (1)
Stoich.:	AB3C4D18E25 (1)
Weight, g/mol:	409.203528
ΔH_f, kcal/mol:	-147.42
Dipole, Da:	5.24
IP(EA), eV:	-9.57(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methyl-3-oxopiperazine-1-carbonyl)-N,N-bis(2-methylpropyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

DOS

IR

Vibrations