Geometry & MOs

Info

ID:	309881
PubChem CID:	126563954
Reduced:	NO7C21H23 (1)
Stoich.:	AB7C21D23 (1)
Weight, g/mol:	260.188863
ΔH_f, kcal/mol:	-234.37
Dipole, Da:	4.92
IP(EA), eV:	-8.93(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-2-methyl-2-pyrrolidin-1-ylpropanamide

Drug info:

PubChemData

Smile

C1C=CC=CC1C2=CC3=C(C=C(C=C3)N[C@H](C=O)[C@@H]([C@H]([C@H](CO)O)O)O)OC2=O

DOS

IR

Vibrations