Geometry & MOs

Info

ID:	253092
PubChem CID:	103115980
Reduced:	O2N6C11H16 (1)
Stoich.:	A2B6C11D16 (1)
Weight, g/mol:	331.00687
ΔH_f, kcal/mol:	1.02
Dipole, Da:	1.14
IP(EA), eV:	-9.69(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=N1)CCN)C2=CN=CN2C

DOS

IR

Vibrations