Geometry & MOs

Info

ID:	351273
PubChem CID:	127280161
Reduced:	SO2N5C16H25 (1)
Stoich.:	AB2C5D16E25 (1)
Weight, g/mol:	353.231456
ΔH_f, kcal/mol:	-33.74
Dipole, Da:	5.65
IP(EA), eV:	-9.04(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(1,4-dioxane-2-carbonyl)piperazin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)C3=CSN=N3

DOS

IR

Vibrations