Geometry & MOs

Info

ID:	234164
PubChem CID:	92297850
Reduced:	O3N5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	368.98614
ΔH_f, kcal/mol:	-37.15
Dipole, Da:	6.55
IP(EA), eV:	-8.73(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN2C3=C(N=C2N1C[C@@H]4CCCO4)N(C(=O)N(C3=O)C/C=C\C5=CC=CC=C5)C

DOS

IR

Vibrations