Geometry & MOs

Info

ID:	313205
PubChem CID:	126612581
Reduced:	NC12H23 (1)
Stoich.:	AB12C23 (1)
Weight, g/mol:	447.336196
ΔH_f, kcal/mol:	-19.75
Dipole, Da:	1.55
IP(EA), eV:	-8.48(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[6-[4-(butylaminomethyl)phenyl]-2-(methylideneamino)pyridin-3-yl]-N-methyl-4-(3-methylpiperidin-1-yl)but-3-en-1-amine

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)CC=C

DOS

IR

Vibrations