Geometry & MOs

Info

ID:	254572
PubChem CID:	103126205
Reduced:	N4C15H16 (1)
Stoich.:	A4B15C16 (1)
Weight, g/mol:	266.153147
ΔH_f, kcal/mol:	96.6
Dipole, Da:	2.8
IP(EA), eV:	-8.91(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methylphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(C2=C3C=NC=CN3N=C2)NC

DOS

IR

Vibrations