Geometry & MOs

Info

ID:	254665
PubChem CID:	103126829
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	336.00443
ΔH_f, kcal/mol:	38.22
Dipole, Da:	1.82
IP(EA), eV:	-8.62(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromothiophen-2-yl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

Drug info:

PubChemData

Smile

CCNC(CC1CCCC1)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations