Geometry & MOs

Info

ID:	199841
PubChem CID:	79306282
Reduced:	BrSN5C12H12 (1)
Stoich.:	ABC5D12E12 (1)
Weight, g/mol:	325.09021
ΔH_f, kcal/mol:	88.1
Dipole, Da:	4.17
IP(EA), eV:	-9.07(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-3-[3-(dimethylamino)-2,2-dimethylpropyl]imidazo[4,5-b]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CSC(=N1)CCN2C3=C(C=C(C=N3)Br)N=C2N

DOS

IR

Vibrations