Geometry & MOs

Info

ID:	253095
PubChem CID:	103116005
Reduced:	O3N5C13H19 (1)
Stoich.:	A3B5C13D19 (1)
Weight, g/mol:	281.12766
ΔH_f, kcal/mol:	-50.77
Dipole, Da:	2.77
IP(EA), eV:	-9.68(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-aminophenyl)methyl]-N-methylpyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations