Geometry & MOs

Info

ID:	152530
PubChem CID:	56311484
Reduced:	N3O4C25H29 (1)
Stoich.:	A3B4C25D29 (1)
Weight, g/mol:	358.225643
ΔH_f, kcal/mol:	-93.08
Dipole, Da:	3.34
IP(EA), eV:	-8.37(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[2-[cyclopropylmethyl(1-phenylethyl)amino]acetyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCC(CC)NC(=O)C1CN(C2=CC=CC=C2O1)CC3=NC=C(O3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations