Geometry & MOs

Info

ID:	373776
PubChem CID:	131319987
Reduced:	BrOSN2C10H11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	286.03169
ΔH_f, kcal/mol:	-23.67
Dipole, Da:	4.91
IP(EA), eV:	-8.05(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-bromo-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)acetate

Drug info:

PubChemData

Smile

CC1=C(N2C(=C1)SC=C2C(C)C(=O)N)Br

DOS

IR

Vibrations