Geometry & MOs

Info

ID:

419882

PubChem CID:

135109577

Reduced:

ON4C13H18 (1)

Stoich.:

AB4C13D18 (1)

Weight, g/mol:

761.331916

ΔHf, kcal/mol:

-2.31

Dipole, Da:

4.41

IP(EA), eV:

-9.11(0.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4R,10S,19S)-15-(2,4-dimethyl-1,3-oxazole-5-carbonyl)-4-(1H-indol-3-ylmethyl)-6,10,12-trimethyl-19-(2-methylpropyl)-21-thia-3,6,9,12,15,18,23-heptazabicyclo[18.2.1]tricosa-1(22),20(23)-diene-2,5,8,11,17-pentone

Drug info:

PubChemData

Smile

CCCN1C=CN=C1CNC(=O)C2=CC=CN2C

DOS

IR

Vibrations