Geometry & MOs

Info

ID:	309638
PubChem CID:	126551648
Reduced:	OF3C24H31 (1)
Stoich.:	AB3C24D31 (1)
Weight, g/mol:	529.297428
ΔH_f, kcal/mol:	-204.75
Dipole, Da:	3.83
IP(EA), eV:	-9.46(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-3-[1-(3-methoxy-5-methylheptanoyl)pyrrolidin-2-yl]-2-methyl-N-[2-phenyl-1-(1,3-thiazol-2-yl)ethyl]propanamide

Drug info:

PubChemData

Smile

C/C=C/CCC1CCC(CC1)C2CCC(=CC2)C3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations