Geometry & MOs

Info

ID:	366696
PubChem CID:	127320225
Reduced:	SO3N5C16H27 (1)
Stoich.:	AB3C5D16E27 (1)
Weight, g/mol:	386.268176
ΔH_f, kcal/mol:	-105.38
Dipole, Da:	4.84
IP(EA), eV:	-8.89(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-benzylpiperidin-4-yl)-methylamino]-N-(cyclohexylcarbamoyl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C1CCS(=O)(=O)C1)N2CCN(CC2)CC3=NC=CN3

DOS

IR

Vibrations