Geometry & MOs

Info

ID:	195678
PubChem CID:	78722515
Reduced:	FN2O4C20H21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	391.153206
ΔH_f, kcal/mol:	-182.7
Dipole, Da:	5.96
IP(EA), eV:	-9.55(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-acetamidophenyl)-1-oxopropan-2-yl] 4-(5-methylpyrazol-1-yl)benzoate

Drug info:

PubChemData

Smile

CCNC(=O)NC(=O)C(C1=CC=CC=C1)OC(=O)CCC2=CC=C(C=C2)F

DOS

IR

Vibrations