Geometry & MOs

Info

ID:	192673
PubChem CID:	78298938
Reduced:	OSN4C6H10 (1)
Stoich.:	ABC4D6E10 (1)
Weight, g/mol:	384.204907
ΔH_f, kcal/mol:	-3.08
Dipole, Da:	5.51
IP(EA), eV:	-9.04(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 15-ethyl-17-hydroxy-11-oxido-1-aza-11-azoniapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate

Drug info:

PubChemData

Smile

CN1C2C(C(=O)NC1=S)NCN2

DOS

IR

Vibrations