Geometry & MOs

Info

ID:	157868
PubChem CID:	56437646
Reduced:	NSF2O2C20H23 (1)
Stoich.:	ABC2D2E20F23 (1)
Weight, g/mol:	352.199822
ΔH_f, kcal/mol:	-159.14
Dipole, Da:	3.32
IP(EA), eV:	-8.74(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]amino]-2-oxoethyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(C1=C(C=C(C=C1)F)F)O)SCC2=CC=CC=C2

DOS

IR

Vibrations