Geometry & MOs

Info

ID:	253059
PubChem CID:	103115784
Reduced:	ON4C13H16 (1)
Stoich.:	AB4C13D16 (1)
Weight, g/mol:	281.12766
ΔH_f, kcal/mol:	29.45
Dipole, Da:	3.98
IP(EA), eV:	-9.1(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(aminomethyl)phenyl]methyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N(C)C2=CC=C(C=C2)CN

DOS

IR

Vibrations