Geometry & MOs

Info

ID:	247240
PubChem CID:	103069037
Reduced:	NC9H12 (2)
Stoich.:	AB9C12 (2)
Weight, g/mol:	260.200097
ΔH_f, kcal/mol:	46.38
Dipole, Da:	3.0
IP(EA), eV:	-8.06(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CCNCC(=C)CN(CC)C1=CC=CC2=CC=CC=C21

DOS

IR

Vibrations