Geometry & MOs

Info

ID:	138308
PubChem CID:	52344538
Reduced:	FN2O3C20H24 (1)
Stoich.:	AB2C3D20E24 (1)
Weight, g/mol:	352.199822
ΔH_f, kcal/mol:	-113.32
Dipole, Da:	3.24
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.130099
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[[(2S)-oxolan-2-yl]methyl]amino]-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1F)[NH+](C)CC(=O)NC[C@@H]2COC3=CC=CC=C3O2

DOS

IR

Vibrations