Geometry & MOs

Info

ID:	397596
PubChem CID:	135030441
Reduced:	NBr2H27C34 (1)
Stoich.:	AB2C27D34 (1)
Weight, g/mol:	319.196756
ΔH_f, kcal/mol:	104.46
Dipole, Da:	1.6
IP(EA), eV:	-8.08(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-1-benzyl-4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carbaldehyde

Drug info:

PubChemData

Smile

CCCCCCN1C2=C(C3=CC4=CC=CC=C4C=C3C(=C2)Br)C5=C1C=C(C6=CC7=CC=CC=C7C=C65)Br

DOS

IR

Vibrations