Geometry & MOs

Info

ID:	438822
PubChem CID:	135228579
Reduced:	ON3C18H25 (1)
Stoich.:	AB3C18D25 (1)
Weight, g/mol:	275.2613
ΔH_f, kcal/mol:	15.71
Dipole, Da:	7.59
IP(EA), eV:	-8.8(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(6-butan-2-ylcyclohexa-1,5-dien-1-yl)butyl]piperidine

Drug info:

PubChemData

Smile

C/C=C\1/C(N2C=NC=C2/C1=C/C=C)CC(C3CCCNC3)O

DOS

IR

Vibrations