Geometry & MOs

Info

ID:	138106
PubChem CID:	52315367
Reduced:	N2O2F3C21H23 (1)
Stoich.:	A2B2C3D21E23 (1)
Weight, g/mol:	374.199428
ΔH_f, kcal/mol:	-228.06
Dipole, Da:	4.31
IP(EA), eV:	-9.82(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-3-[[(2-naphthalen-1-ylacetyl)amino]methyl]benzamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)C1=CC=CC(=C1)CNC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations