Geometry & MOs

Info

ID:	44508
PubChem CID:	10503841
Reduced:	ClSN2O2C25H25 (1)
Stoich.:	ABC2D2E25F25 (1)
Weight, g/mol:	453.06752
ΔH_f, kcal/mol:	-17.27
Dipole, Da:	3.16
IP(EA), eV:	-8.68(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)N(C(C)C)C(=O)OC1=C(SC2=C(C=CC=C2Cl)N3C1=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations