Geometry & MOs

Info

ID:	27366
PubChem CID:	820934
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	322.01056
ΔH_f, kcal/mol:	-28.41
Dipole, Da:	6.68
IP(EA), eV:	-8.89(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)imidazo[2,1-a]isoquinoline

Drug info:

PubChemData

Smile

C1[C@H](CC(=O)C=C1NCCC2=CC=CC=C2)C3=CC=CO3

DOS

IR

Vibrations