Geometry & MOs

Info

ID:	224905
PubChem CID:	85667296
Reduced:	NSO3C19H29 (1)
Stoich.:	ABC3D19E29 (1)
Weight, g/mol:	406.097026
ΔH_f, kcal/mol:	-126.16
Dipole, Da:	6.49
IP(EA), eV:	-8.48(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCCCCCOC1=CC=CC=C1N2C(=O)CS(=O)C2(C)C

DOS

IR

Vibrations