Geometry & MOs

Info

ID:	441241
PubChem CID:	135233767
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	304.226312
ΔH_f, kcal/mol:	-82.19
Dipole, Da:	3.32
IP(EA), eV:	-8.25(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylpropyl)-3-methyl-5-[(2S)-4-(methylamino)butan-2-yl]imidazo[4,5-b]pyridin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CCC1=NC(=C(C=C1)NCC(C)(C)N=O)NC

DOS

IR

Vibrations