Geometry & MOs

Info

ID:	366804
PubChem CID:	127320341
Reduced:	SN3O3C17H25 (1)
Stoich.:	AB3C3D17E25 (1)
Weight, g/mol:	329.177313
ΔH_f, kcal/mol:	-101.14
Dipole, Da:	7.14
IP(EA), eV:	-8.78(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-4-(cyclopropylmethylsulfonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CNC(=O)NC2=CC=CC=C2)S(=O)(=O)CC3CC3

DOS

IR

Vibrations