Geometry & MOs

Info

ID:	390083
PubChem CID:	134996986
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	168.126263
ΔH_f, kcal/mol:	-61.13
Dipole, Da:	2.42
IP(EA), eV:	-9.6(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-oxido-2,3,4,5-tetrahydropyridin-1-ium-6-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(C=O)NC(=O)C2=CC=CC=N2

DOS

IR

Vibrations