Geometry & MOs

Info

ID:	217808
PubChem CID:	85088420
Reduced:	NSSiO5C18H31 (1)
Stoich.:	ABCD5E18F31 (1)
Weight, g/mol:	401.25998
ΔH_f, kcal/mol:	-247.97
Dipole, Da:	3.12
IP(EA), eV:	-9.12(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methylsulfonyl-13-(3-pentyloxiran-2-yl)tridec-5-enamide

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)C1C2N(C1=O)C(=C(CS2(=O)=O)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations