Geometry & MOs

Info

ID:	181977
PubChem CID:	76822435
Reduced:	FNO4C27H36 (1)
Stoich.:	ABC4D27E36 (1)
Weight, g/mol:	501.264587
ΔH_f, kcal/mol:	-215.32
Dipole, Da:	1.5
IP(EA), eV:	-8.95(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-[1-[3-[2-[(4-chloro-3-ethylphenyl)methyl]pyrrolidin-1-yl]-2-hydroxypropoxy]ethyl]phenyl]propanoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC2CCCN2CC(COC(C)C3=CC=CC=C3CCC(=O)OC)O)F

DOS

IR

Vibrations