Geometry & MOs

Info

ID:	34452
PubChem CID:	7978483
Reduced:	N3O4C19H19 (1)
Stoich.:	A3B4C19D19 (1)
Weight, g/mol:	342.109483
ΔH_f, kcal/mol:	-72.72
Dipole, Da:	7.84
IP(EA), eV:	-9.36(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 1-butyl-5-chloro-3-methylpyrazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)C(=O)NNC(=O)COC2=CC=C(C=C2)C#N

DOS

IR

Vibrations