Geometry & MOs

Info

ID:	307377
PubChem CID:	125299734
Reduced:	SO2N6H20C21 (1)
Stoich.:	AB2C6D20E21 (1)
Weight, g/mol:	390.240624
ΔH_f, kcal/mol:	24.99
Dipole, Da:	5.15
IP(EA), eV:	-9.22(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC3=CN=CC=C3)CC4=NC(=O)NC(=O)C4

DOS

IR

Vibrations