Geometry & MOs

Info

ID:	140162
PubChem CID:	52656613
Reduced:	ClO2N6C13H15 (1)
Stoich.:	AB2C6D13E15 (1)
Weight, g/mol:	453.120382
ΔH_f, kcal/mol:	-4.97
Dipole, Da:	11.59
IP(EA), eV:	-9.82(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-pyrazol-1-ylphenyl)-2-[(4S)-4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CN2C=NN=N2

DOS

IR

Vibrations