Geometry & MOs

Info

ID:	416722
PubChem CID:	135090175
Reduced:	N5O5C21H23 (1)
Stoich.:	A5B5C21D23 (1)
Weight, g/mol:	332.23246
ΔH_f, kcal/mol:	-53.3
Dipole, Da:	8.17
IP(EA), eV:	-9.0(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methylamino]-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(OC1)C2=NC(=NO2)CNC(=O)C3=C(ON=C3N4CCOCC4)C5=CC=CC=C5

DOS

IR

Vibrations