Geometry & MOs

Info

ID:	347474
PubChem CID:	127272329
Reduced:	SO2N4C17H28 (1)
Stoich.:	AB2C4D17E28 (1)
Weight, g/mol:	396.310041
ΔH_f, kcal/mol:	-75.27
Dipole, Da:	3.26
IP(EA), eV:	-9.06(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)N2CCC(CC2)C3=NC=CS3)C

DOS

IR

Vibrations