Geometry & MOs

Info

ID:	363422
PubChem CID:	127311225
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	332.196074
ΔH_f, kcal/mol:	-62.38
Dipole, Da:	3.63
IP(EA), eV:	-8.05(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclohexyl(methyl)amino]ethyl]-2-(4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl)acetamide

Drug info:

PubChemData

Smile

CN(C)C1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3CCCCC3C(=O)N4CCCC4

DOS

IR

Vibrations