Geometry & MOs

Info

ID:	358773
PubChem CID:	127296639
Reduced:	O2N5C13H19 (1)
Stoich.:	A2B5C13D19 (1)
Weight, g/mol:	232.157563
ΔH_f, kcal/mol:	-15.39
Dipole, Da:	4.12
IP(EA), eV:	-9.39(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylidenepiperidine-1-carbonyl)cyclohexane-1-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1C=C(N=N1)C(=O)N2CCC(=C)CC2

DOS

IR

Vibrations