Geometry & MOs

Info

ID:	78435
PubChem CID:	49689631
Reduced:	N4O7C20H24 (1)
Stoich.:	A4B7C20D24 (1)
Weight, g/mol:	434.162391
ΔH_f, kcal/mol:	-130.66
Dipole, Da:	7.74
IP(EA), eV:	-9.39(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylsulfamoyl)-N-[[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)CNC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

DOS

IR

Vibrations