Geometry & MOs

Info

ID:	244041
PubChem CID:	99309477
Reduced:	N3O4H27C28 (1)
Stoich.:	A3B4C27D28 (1)
Weight, g/mol:	445.167142
ΔH_f, kcal/mol:	-45.02
Dipole, Da:	2.38
IP(EA), eV:	-9.14(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]-4-(methylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5

DOS

IR

Vibrations