Geometry & MOs

Info

ID:	254107
PubChem CID:	103122780
Reduced:	ClON3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	310.04292
ΔH_f, kcal/mol:	-15.62
Dipole, Da:	5.83
IP(EA), eV:	-8.98(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=NN(C2=CC=CC=C21)C)CCl

DOS

IR

Vibrations