Geometry & MOs

Info

ID:	358697
PubChem CID:	127296487
Reduced:	O2N5C19H29 (1)
Stoich.:	A2B5C19D29 (1)
Weight, g/mol:	351.288577
ΔH_f, kcal/mol:	-38.8
Dipole, Da:	3.26
IP(EA), eV:	-8.83(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-tert-butylcyclohexyl)amino]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC(=C(O1)N2CCN(CC2)C(=O)CN(C3CCCC3)C(C)C)C#N

DOS

IR

Vibrations