Geometry & MOs

Info

ID:

1437

PubChem CID:

4430

Reduced:

N2O3C26H26 (1)

Stoich.:

A2B3C26D26 (1)

Weight, g/mol:

414.194343

ΔHf, kcal/mol:

4.31

Dipole, Da:

2.32

IP(EA), eV:

 -7.72(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

22-(cyclopropylmethyl)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol

Drug info:

PubChemData

Smile

C1CC1CN2CCC34C5C6=C(CC3(C2CC7=C4C(=C(C=C7)O)O5)O)C8=CC=CC=C8N6

DOS

IR

Vibrations