Geometry & MOs

Info

ID:	368933
PubChem CID:	127330952
Reduced:	SN3O3C20H29 (1)
Stoich.:	AB3C3D20E29 (1)
Weight, g/mol:	394.203862
ΔH_f, kcal/mol:	-106.95
Dipole, Da:	7.41
IP(EA), eV:	-9.07(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[cyclohexyl(methyl)sulfamoyl]phenyl]-4-methylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)N3CC4CCC3C4

DOS

IR

Vibrations