Geometry & MOs

Info

ID:	437946
PubChem CID:	135227341
Reduced:	OC19H30 (1)
Stoich.:	AB19C30 (1)
Weight, g/mol:	417.176502
ΔH_f, kcal/mol:	-73.43
Dipole, Da:	3.59
IP(EA), eV:	-9.26(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CCC(CC=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations