Geometry & MOs

Info

ID:	307609
PubChem CID:	125307731
Reduced:	O3N4C23H24 (1)
Stoich.:	A3B4C23D24 (1)
Weight, g/mol:	363.01196
ΔH_f, kcal/mol:	-25.95
Dipole, Da:	4.57
IP(EA), eV:	-9.14(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-3-(2H-indol-3-yl)prop-2-enenitrile

Drug info:

PubChemData

Smile

CCC(=O)NNC(=O)CCN1[C@@H](C2=CC=CC=C2C1=O)C3=C4C=CC=CC4=N[C@H]3C

DOS

IR

Vibrations