Geometry & MOs

Info

ID:	245620
PubChem CID:	99455626
Reduced:	F2N3O5C20H29 (1)
Stoich.:	A2B3C5D20E29 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-305.98
Dipole, Da:	2.84
IP(EA), eV:	-8.97(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propyl]-3-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)[C@@H](C)CNC(=O)CNC(=O)C2=CC(=C(C=C2)OC(F)F)OC

DOS

IR

Vibrations