Geometry & MOs

Info

ID:	386953
PubChem CID:	134983488
Reduced:	OC17H25 (2)
Stoich.:	AB17C25 (2)
Weight, g/mol:	313.123342
ΔH_f, kcal/mol:	-137.32
Dipole, Da:	0.17
IP(EA), eV:	-7.48(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(2-chloro-4-pyrrolidin-1-ylphenyl)-3-phenylpropanal

Drug info:

PubChemData

Smile

CCCCCC1=CC2=C(C=C1CCCCC)C(=C3C=C(C(=CC3=C2O)CCCCC)CCCCC)O

DOS

IR

Vibrations