Geometry & MOs

Info

ID:	210819
PubChem CID:	80857685
Reduced:	FN5C13H18 (1)
Stoich.:	AB5C13D18 (1)
Weight, g/mol:	281.02761
ΔH_f, kcal/mol:	14.42
Dipole, Da:	4.11
IP(EA), eV:	-8.86(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-methylpyrazin-2-amine

Drug info:

PubChemData

Smile

CCC1=C(N(N=C1C)C2=NC(=NC=C2F)NCC)C

DOS

IR

Vibrations