Geometry & MOs

Info

ID:	58444
PubChem CID:	24701462
Reduced:	ON2C9H20 (1)
Stoich.:	AB2C9D20 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	-77.98
Dipole, Da:	3.64
IP(EA), eV:	-9.43(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-cyanophenyl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)CCCCCCN

DOS

IR

Vibrations