Geometry & MOs

Info

ID:	446563
PubChem CID:	135276028
Reduced:	N3C9H13 (2)
Stoich.:	A3B9C13 (2)
Weight, g/mol:	344.196074
ΔH_f, kcal/mol:	63.19
Dipole, Da:	2.53
IP(EA), eV:	-8.35(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[7-(2-methoxyethoxy)-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]butane-1,4-diamine

Drug info:

PubChemData

Smile

CC1=NN=C2N1C3=C(C=C(C=C3)C(C)C)N=C2N(C)CCCCN

DOS

IR

Vibrations