Geometry & MOs

Info

ID:	448869
PubChem CID:	135294171
Reduced:	PN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	459.361348
ΔH_f, kcal/mol:	-0.18
Dipole, Da:	4.15
IP(EA), eV:	-9.24(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[2-[1-(4,4a,5,6,7,8-hexahydronaphthalen-2-yl)ethylideneamino]phenyl]but-3-en-2-yl]-N,N-diethylpiperidin-4-amine

Drug info:

PubChemData

Smile

CN(C(=O)C1=CC(=NC2=CC=CC=C21)P)OC

DOS

IR

Vibrations