Geometry & MOs

Info

ID:	446211
PubChem CID:	135273166
Reduced:	NC12H21 (1)
Stoich.:	AB12C21 (1)
Weight, g/mol:	371.330048
ΔH_f, kcal/mol:	26.37
Dipole, Da:	1.92
IP(EA), eV:	-9.03(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-tert-butylphenyl)-4-[(1-tert-butylpiperidin-4-yl)methyl]piperazine

Drug info:

PubChemData

Smile

CC(C)C(=C)CCC(C=C=C)NC

DOS

IR

Vibrations