Geometry & MOs

Info

ID:	254110
PubChem CID:	103122786
Reduced:	ClON3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	308.02727
ΔH_f, kcal/mol:	17.39
Dipole, Da:	3.01
IP(EA), eV:	-8.84(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(bromomethyl)cyclopropyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(=O)NCC3(CC3)CCl

DOS

IR

Vibrations