Geometry & MOs

Info

ID:	348662
PubChem CID:	127273773
Reduced:	ON9C16H19 (1)
Stoich.:	AB9C16D19 (1)
Weight, g/mol:	355.175673
ΔH_f, kcal/mol:	90.87
Dipole, Da:	8.26
IP(EA), eV:	-9.44(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2C=NN=N2)NC(=O)NC3CCC4=NC(=NN4C3)C

DOS

IR

Vibrations