Geometry & MOs

Info

ID:	156171
PubChem CID:	56369398
Reduced:	N2O5C25H30 (1)
Stoich.:	A2B5C25D30 (1)
Weight, g/mol:	395.16452
ΔH_f, kcal/mol:	-178.25
Dipole, Da:	3.62
IP(EA), eV:	-8.79(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carbonyl]-methylamino]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CN(C)C(=O)C1CCC(=O)N(C1C2=CC=CC=C2OC)C3=CC=C(C=C3)C

DOS

IR

Vibrations