Geometry & MOs

Info

ID:	229019
PubChem CID:	87566792
Reduced:	SO4N5H27C30 (1)
Stoich.:	AB4C5D27E30 (1)
Weight, g/mol:	905.400388
ΔH_f, kcal/mol:	3.06
Dipole, Da:	5.35
IP(EA), eV:	-8.11(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COCCNC1=C(C(=O)C1=O)N2CCC3=C2C=C(C=C3)NC(=O)C4=C(C=CS4)NCC5=CC=NC6=CC=CC=C56

DOS

IR

Vibrations