Geometry & MOs

Info

ID:

297079

PubChem CID:

117608008

Reduced:

NO4C15H27 (1)

Stoich.:

AB4C15D27 (1)

Weight, g/mol:

568.326085

ΔHf, kcal/mol:

-232.6

Dipole, Da:

3.21

IP(EA), eV:

-10.14(0.46)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3R)-N-[(2R)-1-[[(2S)-1-[[(2S)-3-(cyclopenten-1-yl)-1-[(2R)-2-methyloxiran-2-yl]-1-oxopropan-2-yl]amino]-3-(4-methoxyphenyl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]-1-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCOC(=O)[C@@H](C)NC(=O)C1CCC(CC1)(C)O

DOS

IR

Vibrations