Geometry & MOs

Info

ID:	384568
PubChem CID:	134977235
Reduced:	NSSnO3C33H51 (1)
Stoich.:	ABCD3E33F51 (1)
Weight, g/mol:	270.183109
ΔH_f, kcal/mol:	-104.3
Dipole, Da:	6.03
IP(EA), eV:	-9.08(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-ethyl-2-(3-methylpent-1-en-3-yl)propanedioate

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)C=C=C[C@H](CC1=CC=CC=C1)NS(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C

DOS

IR

Vibrations