Geometry & MOs

Info

ID:	183989
PubChem CID:	77099776
Reduced:	BrON3H12C15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	273.06689
ΔH_f, kcal/mol:	60.62
Dipole, Da:	5.93
IP(EA), eV:	-8.45(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-(1-ethyl-3H-imidazo[4,5-c]pyridin-2-ylidene)cyclohexa-2,5-dien-1-one

Drug info:

PubChemData

Smile

C1CC1N2C3=C(C=NC=C3)NC2=C4C=C(C=CC4=O)Br

DOS

IR

Vibrations