Geometry & MOs

Info

ID:	71086
PubChem CID:	48414270
Reduced:	OF2N5H17C18 (1)
Stoich.:	AB2C5D17E18 (1)
Weight, g/mol:	373.04259
ΔH_f, kcal/mol:	-29.45
Dipole, Da:	4.7
IP(EA), eV:	-9.36(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromonaphthalen-2-yl)oxy-N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=NN(C3=C2CCC3)C4=CC(=C(C=C4)F)F

DOS

IR

Vibrations