Geometry & MOs

Info

ID:	79606
PubChem CID:	49829703
Reduced:	O3N4C22H34 (1)
Stoich.:	A3B4C22D34 (1)
Weight, g/mol:	402.161329
ΔH_f, kcal/mol:	-64.86
Dipole, Da:	4.45
IP(EA), eV:	-8.83(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methoxyphenyl)methyl]-3-(2-methylpiperidin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CC1C[NH+](CC(O1)C)C(C)(C)C[NH2+]C(C2=CC=CC=C2)C(=O)NC3=NOC(=C3)C

DOS

IR

Vibrations