Geometry & MOs

Info

ID:	275678
PubChem CID:	103817035
Reduced:	ClION3H7C11 (1)
Stoich.:	ABCD3E7F11 (1)
Weight, g/mol:	378.93349
ΔH_f, kcal/mol:	44.43
Dipole, Da:	2.23
IP(EA), eV:	-9.31(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-bromo-3-(trifluoromethyl)phenyl]-5-chloropyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)I)NC(=O)C2=CN=C(C=N2)Cl

DOS

IR

Vibrations