Geometry & MOs

Info

ID:

415486

PubChem CID:

135088482

Reduced:

N2O2C17H26 (1)

Stoich.:

A2B2C17D26 (1)

Weight, g/mol:

760.3479

ΔHf, kcal/mol:

-78.42

Dipole, Da:

2.73

IP(EA), eV:

 -8.83(0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4R,10S,19S)-4-(1H-indol-3-ylmethyl)-6,10,12-trimethyl-19-(2-methylpropyl)-15-(3-pyrazol-1-ylpropanoyl)-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

CN1CCC[C@]2([C@H]1CN(CC2)CC3=CC(=CC=C3)O)CO

DOS

IR

Vibrations