Geometry & MOs

Info

ID:	371254
PubChem CID:	127344475
Reduced:	OSN4C17H28 (1)
Stoich.:	ABC4D17E28 (1)
Weight, g/mol:	330.241962
ΔH_f, kcal/mol:	-53.52
Dipole, Da:	1.05
IP(EA), eV:	-8.78(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bicyclo[2.2.1]heptanyl)-3-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

CC1CSCCN1C(=O)NC2CCC3=NC(=CN3C2)C(C)(C)C

DOS

IR

Vibrations