Geometry & MOs

Info

ID:	318805
PubChem CID:	126653338
Reduced:	NOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	254.123069
ΔH_f, kcal/mol:	-47.18
Dipole, Da:	4.87
IP(EA), eV:	-9.23(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-4-[4-(dimethylamino)-2,6-difluorophenyl]-3-methylpyrrolidin-2-one

Drug info:

PubChemData

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C[C@@H]1[C@H]([C@H](NC1=O)C)C2=CC=C(C=C2)C

DOS

IR

Vibrations