Geometry & MOs

Info

ID:	443067
PubChem CID:	135257596
Reduced:	NSF5O5C21H22 (1)
Stoich.:	ABC5D5E21F22 (1)
Weight, g/mol:	314.163043
ΔH_f, kcal/mol:	-398.34
Dipole, Da:	2.14
IP(EA), eV:	-9.46(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H](CCOCC1=CC=CC=C1)NS(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations