Geometry & MOs

Info

ID:	157550
PubChem CID:	56435665
Reduced:	N3O4C23H33 (1)
Stoich.:	A3B4C23D33 (1)
Weight, g/mol:	419.156909
ΔH_f, kcal/mol:	-115.75
Dipole, Da:	5.62
IP(EA), eV:	-8.56(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC)C(C)(C)C

DOS

IR

Vibrations