Geometry & MOs

Info

ID:	71108
PubChem CID:	48414297
Reduced:	O2N5H19C20 (1)
Stoich.:	A2B5C19D20 (1)
Weight, g/mol:	412.130218
ΔH_f, kcal/mol:	56.83
Dipole, Da:	5.15
IP(EA), eV:	-9.29(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NC(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations