Geometry & MOs

Info

ID:	254794
PubChem CID:	103127731
Reduced:	BrSN3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	283.179696
ΔH_f, kcal/mol:	89.82
Dipole, Da:	3.03
IP(EA), eV:	-8.74(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(1-methylimidazol-2-yl)-1-(1-methylindazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

CCCNC(C1=CSC=C1Br)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations