Geometry & MOs

Info

ID:	405991
PubChem CID:	135076194
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	466.07534
ΔH_f, kcal/mol:	-141.67
Dipole, Da:	4.63
IP(EA), eV:	-9.69(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R)-16-[(Z)-2-iodobut-2-enyl]-12-oxo-8,16-diazatetracyclo[7.4.3.01,9.02,7]hexadeca-2,4,6-triene-8-carboxylate

Drug info:

PubChemData

Smile

CN(C)C(=O)OC1=CC=CC(=C1)C(=O)OC

DOS

IR

Vibrations