Geometry & MOs

Info

ID:	378594
PubChem CID:	134224686
Reduced:	ClFNO4C16H23 (1)
Stoich.:	ABCD4E16F23 (1)
Weight, g/mol:	215.069477
ΔH_f, kcal/mol:	-245.45
Dipole, Da:	4.2
IP(EA), eV:	-9.39(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(furan-2-ylmethyl)-7H-imidazo[1,2-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)CC(C1=C(C=CC=C1F)C(CO)Cl)O

DOS

IR

Vibrations