Geometry & MOs

Info

ID:	360024
PubChem CID:	127300292
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	359.268511
ΔH_f, kcal/mol:	-39.4
Dipole, Da:	6.8
IP(EA), eV:	-8.6(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CC1CNC(=O)NC2CCC3=NC(=CN3C2)C(C)(C)C

DOS

IR

Vibrations