Geometry & MOs

Info

ID:	122929
PubChem CID:	50826779
Reduced:	ClO4N5C25H30 (1)
Stoich.:	AB4C5D25E30 (1)
Weight, g/mol:	486.201553
ΔH_f, kcal/mol:	-88.09
Dipole, Da:	2.61
IP(EA), eV:	-8.84(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[2-[(2-methoxyphenyl)carbamoyl-methylamino]ethyl]-1,2,4-oxadiazol-5-yl]-N-(pyridin-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)OCCCNC(=O)C1=CC=C(C=C1)C2=NC(=NO2)CCN(C)C(=O)NC3=CC=C(C=C3)Cl

DOS

IR

Vibrations