Geometry & MOs

Info

ID:	336370
PubChem CID:	127255377
Reduced:	O6C11H12 (1)
Stoich.:	A6B11C12 (1)
Weight, g/mol:	403.07831
ΔH_f, kcal/mol:	-211.19
Dipole, Da:	3.83
IP(EA), eV:	-10.04(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 4-[(3-bromophenoxy)methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC(=O)OC1=C(OC=CC1=O)C(=O)OCC

DOS

IR

Vibrations