Geometry & MOs

Info

ID:	222334
PubChem CID:	85296977
Reduced:	NO4C22H39 (1)
Stoich.:	AB4C22D39 (1)
Weight, g/mol:	385.07923
ΔH_f, kcal/mol:	-236.99
Dipole, Da:	2.89
IP(EA), eV:	-10.18(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-phenylselanyl-3-piperidin-1-ylbutanedioate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(C1C=CC(=O)N1C(=O)OC(C)(C)C)O

DOS

IR

Vibrations