Geometry & MOs

Info

ID:	46815
PubChem CID:	10527518
Reduced:	ClNSO4C23H28 (1)
Stoich.:	ABCD4E23F28 (1)
Weight, g/mol:	452.182286
ΔH_f, kcal/mol:	-155.91
Dipole, Da:	4.73
IP(EA), eV:	-9.14(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC(=O)CCCC1=CC=C(C=C1)C(C2CCCC2)NS(=O)(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations