Geometry & MOs

Info

ID:

419685

PubChem CID:

135108700

Reduced:

NO4C20H25 (1)

Stoich.:

AB4C20D25 (1)

Weight, g/mol:

572.285952

ΔHf, kcal/mol:

-157.16

Dipole, Da:

6.45

IP(EA), eV:

 -9.07(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(14R)-20-[3-(1H-benzimidazol-2-yl)propanoyl]-8,14-dimethyl-5-oxa-1,13,16,20,23,24-hexazatricyclo[20.2.1.06,11]pentacosa-6(11),7,9,22(25),23-pentaene-12,15-dione

Drug info:

PubChemData

Smile

CC1=CC2(CCN(CC2)C(=O)C3=C(OC4=C3C(=O)CCC4)C)OCC1

DOS

IR

Vibrations