Geometry & MOs

Info

ID:	197247
PubChem CID:	78942336
Reduced:	N2O2F3C13H17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-229.58
Dipole, Da:	8.2
IP(EA), eV:	-9.54(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-methyl-N-(1-phenylethyl)acetamide

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1CNC(=O)CNCC(F)(F)F

DOS

IR

Vibrations