Geometry & MOs

Info

ID:	64218
PubChem CID:	29198541
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	409.203528
ΔH_f, kcal/mol:	-76.77
Dipole, Da:	10.86
IP(EA), eV:	-8.88(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-2-piperidin-1-yl-5-piperidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

COCCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2

DOS

IR

Vibrations