Geometry & MOs

Info

ID:

351785

PubChem CID:

127282185

Reduced:

O3N4C18H28 (1)

Stoich.:

A3B4C18D28 (1)

Weight, g/mol:

362.231791

ΔHf, kcal/mol:

-101.38

Dipole, Da:

4.09

IP(EA), eV:

-9.1(-0.33)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations