Geometry & MOs

Info

ID:	18392
PubChem CID:	540178
Reduced:	Cl2O3N5H13C16 (1)
Stoich.:	A2B3C5D13E16 (1)
Weight, g/mol:	393.039545
ΔH_f, kcal/mol:	8.36
Dipole, Da:	7.01
IP(EA), eV:	-9.36(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-chloro-1-methylpyrazole-3-carbonyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NNC(=O)C3=NN(C=C3Cl)C

DOS

IR

Vibrations