Geometry & MOs

Info

ID:	158165
PubChem CID:	56463085
Reduced:	ON2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	396.196154
ΔH_f, kcal/mol:	15.06
Dipole, Da:	6.98
IP(EA), eV:	-8.78(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NC(C3=NC(=NO3)C4CC4)C(C)C

DOS

IR

Vibrations