Geometry & MOs

Info

ID:	172000
PubChem CID:	75451951
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	434.151158
ΔH_f, kcal/mol:	35.05
Dipole, Da:	1.38
IP(EA), eV:	-8.64(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-5-methoxyphenyl)-4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CC(CNC1=NC=NC2=C1C(=CC=C2)[N+](=O)[O-])CN3CCCCC3

DOS

IR

Vibrations