Geometry & MOs

Info

ID:	335987
PubChem CID:	127254994
Reduced:	O2N5C15H15 (1)
Stoich.:	A2B5C15D15 (1)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	10.83
Dipole, Da:	1.75
IP(EA), eV:	-9.08(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclopentylethyl)-7-(2,3,4-trimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidine

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C=CC(=C2)NC(=O)CCN3C=CC=C3)N=N1

DOS

IR

Vibrations