Geometry & MOs

Info

ID:	78351
PubChem CID:	49688699
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	-109.2
Dipole, Da:	5.34
IP(EA), eV:	-9.7(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)N1CCC(CC1)CNC(=O)C2=CC=CC=N2

DOS

IR

Vibrations