Geometry & MOs

Info

ID:	346081
PubChem CID:	127270569
Reduced:	SO2N5C18H31 (1)
Stoich.:	AB2C5D18E31 (1)
Weight, g/mol:	395.28964
ΔH_f, kcal/mol:	-75.91
Dipole, Da:	1.72
IP(EA), eV:	-8.74(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-4-(4-methylpiperazine-1-carbonyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CN2CCN(CC2)C(=O)NCCN3CCOC(C3)(C)C

DOS

IR

Vibrations