Geometry & MOs

Info

ID:	372232
PubChem CID:	131294514
Reduced:	ON2S2H8C9 (1)
Stoich.:	AB2C2D8E9 (1)
Weight, g/mol:	238.01056
ΔH_f, kcal/mol:	28.31
Dipole, Da:	3.77
IP(EA), eV:	-8.61(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(8-bromoindolizin-2-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(N=CS1)C(=O)C2=CSC(=C2)N

DOS

IR

Vibrations