Geometry & MOs

Info

ID:

368777

PubChem CID:

127330096

Reduced:

NO2C9H12 (2)

Stoich.:

AB2C9D12 (2)

Weight, g/mol:

361.200156

ΔHf, kcal/mol:

-147.9

Dipole, Da:

2.77

IP(EA), eV:

-9.59(-0.37)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(5-methylpyridin-2-yl)-1-[2-(oxolan-3-ylmethoxy)acetyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1COCC1COCC(=O)N2CCNC(=O)CC2C3=CC=CC=C3

DOS

IR

Vibrations