Geometry & MOs

Info

ID:	396842
PubChem CID:	135029309
Reduced:	N2O3H10C16 (1)
Stoich.:	A2B3C10D16 (1)
Weight, g/mol:	670.268771
ΔH_f, kcal/mol:	-22.59
Dipole, Da:	1.65
IP(EA), eV:	-8.96(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,14R)-6,13-dibenzyl-5,14-diphenyl-3,16-dioxa-21,22-dithia-6,13-diazatricyclo[16.2.1.18,11]docosa-1(20),8,10,18-tetraene

Drug info:

PubChemData

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C1C2=CC=CC=C2N=C3N1C(=O)C4=CC5=C(C=C43)OCO5

DOS

IR

Vibrations