Geometry & MOs

Info

ID:

75592

PubChem CID:

48423710

Reduced:

N4O5C21H24 (1)

Stoich.:

A4B5C21D24 (1)

Weight, g/mol:

358.262028

ΔHf, kcal/mol:

-89.69

Dipole, Da:

4.43

IP(EA), eV:

-8.95(-1.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations