Geometry & MOs

Info

ID:

345566

PubChem CID:

127269866

Reduced:

SO2N3C15H17 (1)

Stoich.:

AB2C3D15E17 (1)

Weight, g/mol:

378.299476

ΔHf, kcal/mol:

-54.33

Dipole, Da:

2.75

IP(EA), eV:

-8.73(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(cyclohexylcarbamoylamino)-N-(2-cyclohexylethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)NCC2=CSC3=CC=CC=C32

DOS

IR

Vibrations