Geometry & MOs

Info

ID:	182814
PubChem CID:	76940180
Reduced:	ClON2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	294.140199
ΔH_f, kcal/mol:	2.56
Dipole, Da:	3.78
IP(EA), eV:	-10.03(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfonyl-N-(3-phenylprop-2-enyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CC=CCOC1=NC(=NC=C1)Cl

DOS

IR

Vibrations