Geometry & MOs

Info

ID:	343155
PubChem CID:	127266328
Reduced:	ON7C16H19 (1)
Stoich.:	AB7C16D19 (1)
Weight, g/mol:	325.165108
ΔH_f, kcal/mol:	61.73
Dipole, Da:	4.15
IP(EA), eV:	-8.51(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-5-propylpyrazol-3-yl)-3-(5-pyridin-3-yl-1H-pyrazol-3-yl)urea

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(C)C)NC(=O)NC2=NNC(=C2)C3=CC=NC=C3

DOS

IR

Vibrations