Geometry & MOs

Info

ID:	356087
PubChem CID:	127291123
Reduced:	N2O3C14H24 (1)
Stoich.:	A2B3C14D24 (1)
Weight, g/mol:	395.187878
ΔH_f, kcal/mol:	-125.5
Dipole, Da:	3.64
IP(EA), eV:	-9.52(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-4-(4-propan-2-ylphenyl)sulfonylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)NC(=O)N(CC2CCOC2)C3CC3

DOS

IR

Vibrations