Geometry & MOs

Info

ID:	354069
PubChem CID:	127285868
Reduced:	N2O2C8H11 (2)
Stoich.:	A2B2C8D11 (2)
Weight, g/mol:	373.18017
ΔH_f, kcal/mol:	-134.52
Dipole, Da:	5.73
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(cyclohexylmethyl)-1H-pyrazol-3-yl]-2-(6-fluoro-4H-1,3-benzodioxin-8-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=C1C(=O)NN2C)C)CC(=O)NCC3COCCO3

DOS

IR

Vibrations