Geometry & MOs

Info

ID:	38580
PubChem CID:	8137133
Reduced:	N2O4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	389.137556
ΔH_f, kcal/mol:	-183.14
Dipole, Da:	6.01
IP(EA), eV:	-8.21(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-diphenylpyrazol-4-yl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate

Drug info:

PubChemData

Smile

C1CCC(CC1)CCC(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

DOS

IR

Vibrations