Geometry & MOs

Info

ID:	298493
PubChem CID:	117650207
Reduced:	N3O7C30H33 (1)
Stoich.:	A3B7C30D33 (1)
Weight, g/mol:	257.139625
ΔH_f, kcal/mol:	-173.17
Dipole, Da:	3.07
IP(EA), eV:	-9.01(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[4-[dideuterio(fluoro)methoxy]phenyl]-2-methyl-2-(methylamino)propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)OCON2C3=CC=CC=C3C=N2)C(=O)OCC4=CC=C(C=C4)OC

DOS

IR

Vibrations