Geometry & MOs

Info

ID:	252286
PubChem CID:	103110267
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	249.15896
ΔH_f, kcal/mol:	-47.64
Dipole, Da:	6.38
IP(EA), eV:	-8.42(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-cyano-2,5-dimethylpyrazol-3-yl)amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)NCC2=C(C(=CC=C2)N)C

DOS

IR

Vibrations