Geometry & MOs

Info

ID:	71094
PubChem CID:	48414280
Reduced:	FO2N4C15H17 (1)
Stoich.:	AB2C4D15E17 (1)
Weight, g/mol:	315.194677
ΔH_f, kcal/mol:	-84.97
Dipole, Da:	4.95
IP(EA), eV:	-9.73(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-5-propan-2-ylphenoxy)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CNC(=O)CC2=CC(=CC=C2)F

DOS

IR

Vibrations