Geometry & MOs

Info

ID:	360025
PubChem CID:	127300293
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	371.243359
ΔH_f, kcal/mol:	-55.73
Dipole, Da:	6.66
IP(EA), eV:	-8.6(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN2CC(CCC2=N1)NC(=O)NC3CCN4C3CCCC4

DOS

IR

Vibrations