Geometry & MOs

Info

ID:	433549
PubChem CID:	135173689
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	296.225249
ΔH_f, kcal/mol:	-71.75
Dipole, Da:	2.86
IP(EA), eV:	-9.07(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2Z,4Z)-hepta-2,4,6-trienyl]-4-[2-(1-methylazetidin-3-yl)ethyl]-3-methylidenecyclohexa-1,4-dien-1-amine

Drug info:

PubChemData

Smile

C[C@]1(CCN1C(=O)OCC2=CC=CC=C2)CCCNC

DOS

IR

Vibrations