Geometry & MOs

Info

ID:	157635
PubChem CID:	56436192
Reduced:	OCl2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-31.71
Dipole, Da:	4.46
IP(EA), eV:	-9.17(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-ditert-butylpyrazol-3-yl)-2,3-dimethoxybenzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=C(C=CC(=C2)Cl)Cl)C(C)(C)C

DOS

IR

Vibrations