Geometry & MOs

Info

ID:	253423
PubChem CID:	103118344
Reduced:	FION3H11C15 (1)
Stoich.:	ABCD3E11F15 (1)
Weight, g/mol:	344.02727
ΔH_f, kcal/mol:	15.34
Dipole, Da:	6.45
IP(EA), eV:	-8.91(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2-ethylphenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3)F)I

DOS

IR

Vibrations