Geometry & MOs

Info

ID:	121763
PubChem CID:	50780546
Reduced:	O3N4C24H26 (1)
Stoich.:	A3B4C24D26 (1)
Weight, g/mol:	473.206304
ΔH_f, kcal/mol:	-42.76
Dipole, Da:	5.9
IP(EA), eV:	-8.46(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)phenyl]-N-(3,4-dimethoxyphenyl)-3-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)CNC(=O)C2=CC=C(C=C2)C3=NOC(=N3)C4CCCC4

DOS

IR

Vibrations