Geometry & MOs

Info

ID:	171688
PubChem CID:	75413634
Reduced:	FSN3H12C17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	308.127326
ΔH_f, kcal/mol:	72.04
Dipole, Da:	4.64
IP(EA), eV:	-9.22(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[cyclopropyl(phenyl)methyl]-3-nitroimidazo[1,2-a]pyridin-2-amine

Drug info:

PubChemData

Smile

C1=CSC(=C1)C(C2=CC=C(C=C2)F)NC3=NC=C(C=C3)C#N

DOS

IR

Vibrations