Geometry & MOs

Info

ID:	354567
PubChem CID:	127287181
Reduced:	ON4C21H30 (1)
Stoich.:	AB4C21D30 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	-30.61
Dipole, Da:	2.54
IP(EA), eV:	-8.13(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-(2-propan-2-ylcyclohexyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)NC=C2CCNC(=O)N3CCCC3CN4CCCC4

DOS

IR

Vibrations