Geometry & MOs

Info

ID:	276377
PubChem CID:	103822812
Reduced:	FON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	283.225977
ΔH_f, kcal/mol:	-89.13
Dipole, Da:	3.89
IP(EA), eV:	-9.14(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-(azepan-1-yl)-1-oxopropan-2-yl]amino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)(CNC1CCC2=C1C=CC=C2F)C(=O)NC

DOS

IR

Vibrations