Geometry & MOs

Info

ID:	76975
PubChem CID:	48425651
Reduced:	N2O5C19H28 (1)
Stoich.:	A2B5C19D28 (1)
Weight, g/mol:	304.164774
ΔH_f, kcal/mol:	-205.54
Dipole, Da:	6.33
IP(EA), eV:	-8.67(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCCOC1=C(C=C(C=C1)C(=O)C)OC

DOS

IR

Vibrations